"Fossies" - the Fresh Open Source Software Archive

Contents of openbabel-3.1.1-source.tar.bz2 (8 May 2020, 27743669 Bytes)

About: Open Babel is a chemical toolbox designed to speak the many languages of chemical data. It’s an open, collaborative project allowing anyone to search, convert, analyze, or store data from molecular modeling, chemistry, solid-state materials, biochemistry, or related areas.



Fossies downloads: /linux/miscopenbabel-3.1.1-source.tar.bz2  (tar.gz|tar.xz|zip)
Fossies services: Doxygen docs | CLOC analysis
Original URL: https://github.com/openbabel/openbabel/releases/download/openbabel-3-1-1/openbabel-3.1.1-source.tar.bz2
Home page: https://openbabel.org/
VirusTotal check: Ok
Member paths+URLs:  Shortened | full
Member sort order:  docs related | original | size (top100) | date | path | name | ext | top-path files

      dir 2020-05-08 17:55 
      dir 2020-05-08 17:41 tools/
    2215 2020-05-08 17:41 INSTALL
   28435 2020-05-08 17:41 CMakeLists.txt
      dir 2020-05-08 17:41 test/
      dir 2020-05-08 17:41 cmake/
     703 2020-05-08 17:41 OpenBabel3Config.cmake.in
     465 2020-05-08 17:41 AUTHORS
     308 2020-05-08 17:41 openbabel-3.pc.cmake
     240 2020-05-08 17:41 CTestConfig.cmake
      dir 2020-05-08 17:41 include/
    1703 2020-05-08 17:41 README.md
   15146 2020-05-08 17:41 COPYING
     572 2020-05-08 17:41 OpenBabel3ConfigVersion.cmake.in
      dir 2020-05-08 17:41 scripts/
      dir 2020-05-08 17:41 doc/
    1940 2020-05-08 17:41 THANKS
      dir 2020-05-08 17:55 external/
    1211 2020-05-08 17:41 authors.txt
      dir 2020-05-08 17:41 data/
      97 2020-05-08 17:41 .misspell-fixer.ignore
      dir 2020-05-08 17:41 src/
     118 2020-05-08 17:41 src/memcpy.c
    6636 2020-05-08 17:41 src/data_utilities.cpp
    1013 2020-05-08 17:41 src/snprintf.h
   13360 2020-05-08 17:41 src/alias.cpp
    1042 2020-05-08 17:41 src/op.cpp
   20933 2020-05-08 17:41 src/descriptor.cpp
   30393 2020-05-08 17:41 src/typer.cpp
    2880 2020-05-08 17:41 src/query.cpp
   18762 2020-05-08 17:41 src/bond.cpp
  168048 2020-05-08 17:41 src/elements.cpp
   14297 2020-05-08 17:41 src/kekulize.cpp
    6643 2020-05-08 17:41 src/CMakeLists.txt
    7119 2020-05-08 17:41 src/griddata.cpp
      dir 2020-05-08 17:41 src/stereo/
    2006 2020-05-08 17:41 src/strncasecmp.c
      dir 2020-05-08 17:41 src/formats/
    3899 2020-05-08 17:41 src/format.cpp
    3965 2020-05-08 17:41 src/locale.cpp
    6544 2020-05-08 17:41 src/tokenst.cpp
   10908 2020-05-08 17:41 src/zipstream.h
    4022 2020-05-08 17:41 src/dlhandler_win32.cpp
   42431 2020-05-08 17:41 src/conformersearch.cpp
   50144 2020-05-08 17:41 src/atom.cpp
   22524 2020-05-08 17:41 src/ring.cpp
      dir 2020-05-08 17:41 src/charges/
   28844 2020-05-08 17:41 src/fingerprint.cpp
   36345 2020-05-08 17:41 src/obiter.cpp
      dir 2020-05-08 17:41 src/forcefields/
   16774 2020-05-08 17:41 src/elementtable.h
    8363 2020-05-08 17:41 src/oberror.cpp
   65500 2020-05-08 17:41 src/chains.cpp
   25753 2020-05-08 17:41 src/zipstreamimpl.h
   46457 2020-05-08 17:41 src/generic.cpp
   21961 2020-05-08 17:41 src/base.cpp
   32032 2020-05-08 17:41 src/residue.cpp
   20402 2020-05-08 17:41 src/data.cpp
      dir 2020-05-08 17:41 src/math/
    4575 2020-05-08 17:41 src/config.h.cmake
   65365 2020-05-08 17:41 src/builder.cpp
    9332 2020-05-08 17:41 src/molchrg.cpp
   77362 2020-05-08 17:41 src/pointgroup.cpp
      dir 2020-05-08 17:41 src/depict/
    9156 2020-05-08 17:41 src/bondtyper.cpp
   69873 2020-05-08 17:41 src/canon.cpp
   23313 2020-05-08 17:41 src/plugin.cpp
  139370 2020-05-08 17:41 src/mol.cpp
   50471 2020-05-08 17:41 src/snprintf.c
   19745 2020-05-08 17:41 src/bitvec.cpp
    9608 2020-05-08 17:41 src/transform.cpp
   49356 2020-05-08 17:41 src/spectrophore.cpp
   11943 2020-05-08 17:41 src/rand.cpp
      dir 2020-05-08 17:41 src/fingerprints/
   14650 2020-05-08 17:41 src/grid.cpp
    9070 2020-05-08 17:41 src/patty.cpp
      dir 2020-05-08 17:41 src/descriptors/
   22122 2020-05-08 17:41 src/rotamer.cpp
   12839 2020-05-08 17:41 src/reactionfacade.cpp
   11436 2020-05-08 17:41 src/matrix.cpp
      dir 2020-05-08 17:41 src/GUI/
   20153 2020-05-08 17:41 src/obmolecformat.cpp
  130864 2020-05-08 17:41 src/forcefield.cpp
    3030 2020-05-08 17:41 src/rand.h
   69932 2020-05-08 17:41 src/parsmart.cpp
   53352 2020-05-08 17:41 src/distgeom.cpp
   15952 2020-05-08 17:41 src/confsearch.cpp
      dir 2020-05-08 17:41 src/ops/
   22697 2020-05-08 17:41 src/isomorphism.cpp
   13517 2020-05-08 17:41 src/doxygen_pages.cpp
    1849 2020-05-08 17:41 src/RDKitConv.cpp
   12654 2020-05-08 17:41 src/phmodel.cpp
  280729 2020-05-08 17:41 src/mcdlutil.cpp
   61584 2020-05-08 17:41 src/obconversion.cpp
   36098 2020-05-08 17:41 src/obutil.cpp
    4914 2020-05-08 17:41 src/dlhandler_unix.cpp
    2063 2020-05-08 17:41 src/chargemodel.cpp
   23722 2020-05-08 17:41 src/graphsym.cpp
   21770 2020-05-08 17:41 src/obfunctions.cpp
   27533 2020-05-08 17:41 src/tautomer.cpp
   30201 2020-05-08 17:41 src/rotor.cpp
    2864 2020-05-08 17:41 src/ops/partialcharges.cpp
    3464 2020-05-08 17:41 src/ops/deferred.h
    4604 2020-05-08 17:41 src/ops/neutralize.cpp
   14236 2020-05-08 17:41 src/ops/opisomorph.cpp
    1894 2020-05-08 17:41 src/ops/addinindex.cpp
    7565 2020-05-08 17:41 src/ops/opsplit.cpp
    6154 2020-05-08 17:41 src/ops/sort.cpp
    2823 2020-05-08 17:41 src/ops/opisomorph.h
    1748 2020-05-08 17:41 src/ops/addnonpolarh.cpp
    5898 2020-05-08 17:41 src/ops/unique.cpp
    2245 2020-05-08 17:41 src/ops/canonical.cpp
    6258 2020-05-08 17:41 src/ops/gen3d.cpp
    1761 2020-05-08 17:41 src/ops/delnonpolarh.cpp
    1722 2020-05-08 17:41 src/ops/addpolarh.cpp
    2711 2020-05-08 17:41 src/ops/gen2D.cpp
    8020 2020-05-08 17:41 src/ops/largest.cpp
    9256 2020-05-08 17:41 src/ops/fillUC.cpp
    8953 2020-05-08 17:41 src/ops/forcefield.cpp
    2047 2020-05-08 17:41 src/ops/addfilename.cpp
    2724 2020-05-08 17:41 src/ops/op2d.cpp
    6428 2020-05-08 17:41 src/ops/xout.cpp
    5846 2020-05-08 17:41 src/ops/opconfab.cpp
    8113 2020-05-08 17:41 src/ops/loader.cpp
    9932 2020-05-08 17:41 src/ops/opalign.cpp
    4001 2020-05-08 17:41 src/ops/optransform.cpp
    4860 2020-05-08 17:41 src/ops/changecell.cpp
   11291 2020-05-08 17:41 src/ops/conformer.cpp
    5294 2020-05-08 17:41 src/ops/ophighlight.cpp
    3810 2020-05-08 17:41 src/ops/readconformers.cpp
    1731 2020-05-08 17:41 src/ops/delpolarh.cpp
      54 2020-05-08 17:41 src/GUI/stdwx.cpp
     409 2020-05-08 17:41 src/GUI/OBGUI.rc
     384 2020-05-08 17:41 src/GUI/CMakeLists.txt
    1437 2020-05-08 17:41 src/GUI/optswx.h
    2823 2020-05-08 17:41 src/GUI/selformats.h
    6089 2020-05-08 17:41 src/GUI/babel.xpm
   44328 2020-05-08 17:41 src/GUI/OBGUI.cpp
    1078 2020-05-08 17:41 src/GUI/babel2.ico
    6731 2020-05-08 17:41 src/GUI/OBGUI.h
   14074 2020-05-08 17:41 src/GUI/optswx.cpp
    1728 2020-05-08 17:41 src/GUI/stdwx.h
    2252 2020-05-08 17:41 src/descriptors/cansmidescriptor.cpp
    7138 2020-05-08 17:41 src/descriptors/groupcontrib.cpp
    3372 2020-05-08 17:41 src/descriptors/cmpdfilter.cpp
    3266 2020-05-08 17:41 src/descriptors/smartsdescriptors.cpp
    6960 2020-05-08 17:41 src/descriptors/filters.cpp
    3428 2020-05-08 17:41 src/descriptors/inchidescriptor.cpp
    8338 2020-05-08 17:41 src/fingerprints/fingerecfp.cpp
   11637 2020-05-08 17:41 src/fingerprints/finger3.cpp
    9015 2020-05-08 17:41 src/fingerprints/finger2.cpp
   42853 2020-05-08 17:41 src/depict/depict.cpp
    3920 2020-05-08 17:41 src/depict/commandpainter.cpp
    6035 2020-05-08 17:41 src/depict/cairopainter.cpp
    7564 2020-05-08 17:41 src/depict/svgpainter.cpp
    6876 2020-05-08 17:41 src/depict/asciipainter.cpp
   10492 2020-05-08 17:41 src/math/vector3.cpp
   21944 2020-05-08 17:41 src/math/matrix3x3.cpp
   13519 2020-05-08 17:41 src/math/align.cpp
   19878 2020-05-08 17:41 src/math/spacegroup.cpp
    4219 2020-05-08 17:41 src/math/transform3d.cpp
    6561 2020-05-08 17:41 src/forcefields/forcefieldgaff.h
   12785 2020-05-08 17:41 src/forcefields/forcefieldmmff94.h
    4700 2020-05-08 17:41 src/forcefields/forcefieldmm2.h
   41475 2020-05-08 17:41 src/forcefields/forcefieldghemical.cpp
  173193 2020-05-08 17:41 src/forcefields/forcefieldmmff94.cpp
   23220 2020-05-08 17:41 src/forcefields/forcefieldmm2.cpp
    6283 2020-05-08 17:41 src/forcefields/forcefielduff.h
   53917 2020-05-08 17:41 src/forcefields/forcefieldgaff.cpp
    6071 2020-05-08 17:41 src/forcefields/forcefieldghemical.h
   64065 2020-05-08 17:41 src/forcefields/forcefielduff.cpp
    1717 2020-05-08 17:41 src/charges/none.cpp
    4312 2020-05-08 17:41 src/charges/fromfile.cpp
   10149 2020-05-08 17:41 src/charges/eem.cpp
    1796 2020-05-08 17:41 src/charges/gasteiger.cpp
    2581 2020-05-08 17:41 src/charges/mmff94.cpp
    2354 2020-05-08 17:41 src/charges/qeq.h
    2608 2020-05-08 17:41 src/charges/eqeq.h
   13111 2020-05-08 17:41 src/charges/qtpie.cpp
   12650 2020-05-08 17:41 src/charges/qeq.cpp
    2567 2020-05-08 17:41 src/charges/qtpie.h
    9241 2020-05-08 17:41 src/charges/eqeq.cpp
   42163 2020-05-08 17:41 src/formats/nwchemformat.cpp
    8064 2020-05-08 17:41 src/formats/exampleformat.cpp
  138419 2020-05-08 17:41 src/formats/fastaformat.cpp
    6008 2020-05-08 17:41 src/formats/thermoformat.cpp
    5569 2020-05-08 17:41 src/formats/gromos96format.cpp
   44934 2020-05-08 17:41 src/formats/mmcifformat.cpp
   43523 2020-05-08 17:41 src/formats/pdbqtformat.cpp
   25776 2020-05-08 17:41 src/formats/fastsearchformat.cpp
    4057 2020-05-08 17:41 src/formats/msmsformat.cpp
   12419 2020-05-08 17:41 src/formats/daltonformat.cpp
   35216 2020-05-08 17:41 src/formats/mopacformat.cpp
    5702 2020-05-08 17:41 src/formats/asciiformat.cpp
    6383 2020-05-08 17:41 src/formats/carformat.cpp
    6404 2020-05-08 17:41 src/formats/boxformat.cpp
      dir 2020-05-08 17:41 src/formats/libinchi/
    7091 2020-05-08 17:41 src/formats/zindoformat.cpp
    6432 2020-05-08 17:41 src/formats/alchemyformat.cpp
    4529 2020-05-08 17:41 src/formats/CMakeLists.txt
    9424 2020-05-08 17:41 src/formats/pointcloudformat.cpp
    4974 2020-05-08 17:41 src/formats/molreport.cpp
   38642 2020-05-08 17:41 src/formats/gamessformat.cpp
   14715 2020-05-08 17:41 src/formats/tinkerformat.cpp
    7137 2020-05-08 17:41 src/formats/dmolformat.cpp
    4712 2020-05-08 17:41 src/formats/shelxformat.cpp
    8819 2020-05-08 17:41 src/formats/bgfformat.cpp
   25518 2020-05-08 17:41 src/formats/chemdrawcdx.cpp
   26518 2020-05-08 17:41 src/formats/mol2format.cpp
    9486 2020-05-08 17:41 src/formats/acesformat.cpp
    2308 2020-05-08 17:41 src/formats/titleformat.cpp
   33092 2020-05-08 17:41 src/formats/fchkformat.cpp
   10975 2020-05-08 17:41 src/formats/rxnformat.cpp
    5827 2020-05-08 17:41 src/formats/fpsformat.cpp
    6915 2020-05-08 17:41 src/formats/pcmodelformat.cpp
    7540 2020-05-08 17:41 src/formats/castepformat.cpp
    2715 2020-05-08 17:41 src/formats/copyformat.cpp
   12268 2020-05-08 17:41 src/formats/gulpformat.cpp
    6716 2020-05-08 17:41 src/formats/hinformat.cpp
    2025 2020-05-08 17:41 src/formats/smilesvalence.h
    8155 2020-05-08 17:41 src/formats/fingerprintformat.cpp
   15752 2020-05-08 17:41 src/formats/lmpdatformat.cpp
   14109 2020-05-08 17:41 src/formats/crkformat.cpp
   29655 2020-05-08 17:41 src/formats/povrayformat.cpp
   11988 2020-05-08 17:41 src/formats/gausszmatformat.cpp
    3556 2020-05-08 17:41 src/formats/ArrayList.c
    5748 2020-05-08 17:41 src/formats/cacheformat.cpp
    9633 2020-05-08 17:41 src/formats/pwscfformat.cpp
   15429 2020-05-08 17:41 src/formats/moldenformat.cpp
   15047 2020-05-08 17:41 src/formats/pngformat.cpp
   10485 2020-05-08 17:41 src/formats/mpdformat.cpp
   14927 2020-05-08 17:41 src/formats/dlpolyformat.cpp
    6803 2020-05-08 17:41 src/formats/xsfformat.cpp
    6143 2020-05-08 17:41 src/formats/wlnformat.cpp
    5586 2020-05-08 17:41 src/formats/aoforceformat.cpp
    5467 2020-05-08 17:41 src/formats/formats.cmake
    7710 2020-05-08 17:41 src/formats/mmodformat.cpp
    6842 2020-05-08 17:41 src/formats/rinchiformat.cpp
   32446 2020-05-08 17:41 src/formats/chemkinformat.cpp
   69817 2020-05-08 17:41 src/formats/cifformat.cpp
   16057 2020-05-08 17:41 src/formats/mdffformat.cpp
    4434 2020-05-08 17:41 src/formats/painterformat.cpp
   15215 2020-05-08 17:41 src/formats/groformat.cpp
    7433 2020-05-08 17:41 src/formats/outformat.cpp
    5102 2020-05-08 17:41 src/formats/genbankformat.cpp
   10630 2020-05-08 17:41 src/formats/molproformat.cpp
    3876 2020-05-08 17:41 src/formats/fhformat.cpp
    5172 2020-05-08 17:41 src/formats/balstformat.cpp
   10960 2020-05-08 17:41 src/formats/maeformat.cpp
      dir 2020-05-08 17:41 src/formats/xml/
  143079 2020-05-08 17:41 src/formats/smilesformat.cpp
   12065 2020-05-08 17:41 src/formats/PQSformat.cpp
    4560 2020-05-08 17:41 src/formats/featformat.cpp
   12643 2020-05-08 17:41 src/formats/MNAformat.cpp
    9389 2020-05-08 17:41 src/formats/chem3dformat.cpp
   13763 2020-05-08 17:41 src/formats/mdlvalence.h
   21834 2020-05-08 17:41 src/formats/exyzformat.cpp
    7213 2020-05-08 17:41 src/formats/posformat.cpp
    5302 2020-05-08 17:41 src/formats/acrformat.cpp
    8146 2020-05-08 17:41 src/formats/rsmiformat.cpp
    9389 2020-05-08 17:41 src/formats/jaguarformat.cpp
      dir 2020-05-08 17:41 src/formats/json/
    8835 2020-05-08 17:41 src/formats/msiformat.cpp
    9919 2020-05-08 17:41 src/formats/crystal09format.cpp
   27413 2020-05-08 17:41 src/formats/vaspformat.cpp
    5314 2020-05-08 17:41 src/formats/turbomoleformat.cpp
    2791 2020-05-08 17:41 src/formats/textformat.cpp
    5152 2020-05-08 17:41 src/formats/CSRformat.cpp
   38559 2020-05-08 17:41 src/formats/adfformat.cpp
   10983 2020-05-08 17:41 src/formats/cacaoformat.cpp
   13157 2020-05-08 17:41 src/formats/cofformat.cpp
    5764 2020-05-08 17:41 src/formats/viewmolformat.cpp
   13256 2020-05-08 17:41 src/formats/qchemformat.cpp
   51548 2020-05-08 17:41 src/formats/gaussformat.cpp
    9349 2020-05-08 17:41 src/formats/png2format.cpp
   42920 2020-05-08 17:41 src/formats/MCDLformat.cpp
   12497 2020-05-08 17:41 src/formats/xyzformat.cpp
   13893 2020-05-08 17:41 src/formats/reportformat.cpp
   42522 2020-05-08 17:41 src/formats/gamessukformat.cpp
    6784 2020-05-08 17:41 src/formats/confabreport.cpp
    9206 2020-05-08 17:41 src/formats/stlformat.cpp
    7448 2020-05-08 17:41 src/formats/getinchi.cpp
   14162 2020-05-08 17:41 src/formats/lpmdformat.cpp
    6074 2020-05-08 17:41 src/formats/mpqcformat.cpp
   19108 2020-05-08 17:41 src/formats/pqrformat.cpp
    1838 2020-05-08 17:41 src/formats/ArrayList.h
   10545 2020-05-08 17:41 src/formats/opendxformat.cpp
   85570 2020-05-08 17:41 src/formats/smiley.h
    4296 2020-05-08 17:41 src/formats/xedformat.cpp
   21949 2020-05-08 17:41 src/formats/svgformat.cpp
    5739 2020-05-08 17:41 src/formats/fhiaimsformat.cpp
   26464 2020-05-08 17:41 src/formats/orcaformat.cpp
   18901 2020-05-08 17:41 src/formats/yasaraformat.cpp
    1209 2020-05-08 17:41 src/formats/nulformat.cpp
   25897 2020-05-08 17:41 src/formats/gausscubeformat.cpp
    8058 2020-05-08 17:41 src/formats/abinitformat.cpp
    4632 2020-05-08 17:41 src/formats/unichemformat.cpp
   14368 2020-05-08 17:41 src/formats/siestaformat.cpp
    8814 2020-05-08 17:41 src/formats/freefracformat.cpp
   42942 2020-05-08 17:41 src/formats/pdbformat.cpp
    4435 2020-05-08 17:41 src/formats/cssrformat.cpp
    4623 2020-05-08 17:41 src/formats/chemtoolformat.cpp
   26828 2020-05-08 17:41 src/formats/inchiformat.cpp
   34884 2020-05-08 17:41 src/formats/xtcformat.cpp
    5098 2020-05-08 17:41 src/formats/chemdrawct.cpp
   52324 2020-05-08 17:41 src/formats/wln-nextmove.cpp
    8290 2020-05-08 17:41 src/formats/ghemicalformat.cpp
   77961 2020-05-08 17:41 src/formats/mdlformat.cpp
    1695 2020-05-08 17:41 src/formats/APIInterface.cpp
    3929 2020-05-08 17:41 src/formats/cccformat.cpp
   15790 2020-05-08 17:41 src/formats/smileyformat.cpp
    3791 2020-05-08 17:41 src/formats/amberformat.cpp
   47023 2020-05-08 17:41 src/formats/json/pubchemjsonformat.cpp
   19920 2020-05-08 17:41 src/formats/json/chemdoodlejsonformat.cpp
    5562 2020-05-08 17:41 src/formats/xml/pubchem.cpp
    3648 2020-05-08 17:41 src/formats/xml/xmlformat.cpp
    4771 2020-05-08 17:41 src/formats/xml/iconv.h
   96480 2020-05-08 17:41 src/formats/xml/cmlformat.cpp
   27074 2020-05-08 17:41 src/formats/xml/cmlreactformat.cpp
   13614 2020-05-08 17:41 src/formats/xml/cdxmlformat.cpp
   16413 2020-05-08 17:41 src/formats/xml/xml.cpp
  172615 2020-05-08 17:41 src/formats/libinchi/ichiprt1.c
   91938 2020-05-08 17:41 src/formats/libinchi/inchi_dll.c
   53346 2020-05-08 17:41 src/formats/libinchi/ichimak2.c
   13393 2020-05-08 17:41 src/formats/libinchi/sha2.c
     915 2020-05-08 17:41 src/formats/libinchi/CMakeLists.txt
   60358 2020-05-08 17:41 src/formats/libinchi/ichirvr5.c
   48644 2020-05-08 17:41 src/formats/libinchi/util.c
  219593 2020-05-08 17:41 src/formats/libinchi/ichirvr1.c
  113102 2020-05-08 17:41 src/formats/libinchi/ikey_base26.c
   60138 2020-05-08 17:41 src/formats/libinchi/ichiqueu.c
   30928 2020-05-08 17:41 src/formats/libinchi/ichi_io.c
   13450 2020-05-08 17:41 src/formats/libinchi/ichilnct.c
   61298 2020-05-08 17:41 src/formats/libinchi/ichiprt2.c
   10900 2020-05-08 17:41 src/formats/libinchi/ichiring.c
   17198 2020-05-08 17:41 src/formats/libinchi/ikey_dll.c
    2081 2020-05-08 17:41 src/formats/libinchi/ichiparm.c
  204863 2020-05-08 17:41 src/formats/libinchi/ichimake.c
   64322 2020-05-08 17:41 src/formats/libinchi/ichirvr6.c
   85970 2020-05-08 17:41 src/formats/libinchi/ichimap4.c
  197522 2020-05-08 17:41 src/formats/libinchi/strutil.c
  105693 2020-05-08 17:41 src/formats/libinchi/inchi_dll_a2.c
  291220 2020-05-08 17:41 src/formats/libinchi/ichirvr2.c
  171869 2020-05-08 17:41 src/formats/libinchi/ichiprt3.c
  358162 2020-05-08 17:41 src/formats/libinchi/ichiread.c
  100468 2020-05-08 17:41 src/formats/libinchi/ichicano.c
   54969 2020-05-08 17:41 src/formats/libinchi/inchi_dll_a.c
   21607 2020-05-08 17:41 src/formats/libinchi/ichisort.c
  111900 2020-05-08 17:41 src/formats/libinchi/ichirvr7.c
   82185 2020-05-08 17:41 src/formats/libinchi/ichicans.c
  168465 2020-05-08 17:41 src/formats/libinchi/ichister.c
   37934 2020-05-08 17:41 src/formats/libinchi/ichimap1.c
  287889 2020-05-08 17:41 src/formats/libinchi/ichirvr3.c
    4873 2020-05-08 17:41 src/formats/libinchi/ichiisot.c
  138620 2020-05-08 17:41 src/formats/libinchi/ichinorm.c
  209320 2020-05-08 17:41 src/formats/libinchi/ichitaut.c
  137336 2020-05-08 17:41 src/formats/libinchi/ichimap2.c
    1904 2020-05-08 17:41 src/formats/libinchi/inchi_dll_main.c
  417340 2020-05-08 17:41 src/formats/libinchi/ichi_bns.c
  146970 2020-05-08 17:41 src/formats/libinchi/ichirvr4.c
  211730 2020-05-08 17:41 src/formats/libinchi/ichican2.c
  194288 2020-05-08 17:41 src/formats/libinchi/runichi.c
  116877 2020-05-08 17:41 src/stereo/perception.cpp
    3652 2020-05-08 17:41 src/stereo/gen3dstereohelper.cpp
    6363 2020-05-08 17:41 src/stereo/facade.cpp
    1261 2020-05-08 17:41 src/stereo/tetranonplanar.cpp
    5465 2020-05-08 17:41 src/stereo/stereoutil.h
    2831 2020-05-08 17:41 src/stereo/stereo.cpp
   13345 2020-05-08 17:41 src/stereo/cistrans.cpp
    2220 2020-05-08 17:41 src/stereo/gen3dstereohelper.h
    2594 2020-05-08 17:41 src/stereo/tetraplanar.cpp
    8557 2020-05-08 17:41 src/stereo/tetrahedral.cpp
    7647 2020-05-08 17:41 src/stereo/squareplanar.cpp
     460 2020-05-08 17:41 data/eem2015bn.txt
    3003 2020-05-08 17:41 data/ringtyp.txt
   14696 2020-05-08 17:41 data/resdata.txt
     460 2020-05-08 17:41 data/eem2015bm.txt
    4357 2020-05-08 17:41 data/logp.txt
   47608 2020-05-08 17:41 data/chemdrawcdx.h
    9963 2020-05-08 17:41 data/torlib.txt
    5881 2020-05-08 17:41 data/bondtyp.txt
    1147 2020-05-08 17:41 data/CMakeLists.txt
   37468 2020-05-08 17:41 data/torlib.h
     775 2020-05-08 17:41 data/space-groups.xsl
    5047 2020-05-08 17:41 data/mmffoop.par
   55768 2020-05-08 17:41 data/mmfftor.par
   31822 2020-05-08 17:41 data/babel_povray3.inc
   50482 2020-05-08 17:41 data/types.h
    1916 2020-05-08 17:41 data/svgformat.script
    6704 2020-05-08 17:41 data/superatom.txt
     460 2020-05-08 17:41 data/eem2015hn.txt
   18162 2020-05-08 17:41 data/phmodeldata.h
    4127 2020-05-08 17:41 data/mr.txt
   55852 2020-05-08 17:41 data/mmffs_tor.par
   39230 2020-05-08 17:41 data/SMARTS_InteLigand.txt
   29869 2020-05-08 17:41 data/torsion.txt
    2400 2020-05-08 17:41 data/plugindefines.txt
    2314 2020-05-08 17:41 data/mmffbndk.par
     460 2020-05-08 17:41 data/eem2015hm.txt
    5074 2020-05-08 17:41 data/mmffs_oop.par
    3900 2020-05-08 17:41 data/bin2hex.pl
    7130 2020-05-08 17:41 data/phmodel.txt
    5942 2020-05-08 17:41 data/mmffvdw.par
    2418 2020-05-08 17:41 data/psa.txt
  338592 2020-05-08 17:41 data/gaff.dat
     569 2020-05-08 17:41 data/mmff94s.ff
    1849 2020-05-08 17:41 data/templates.sdf
  127434 2020-05-08 17:41 data/mm2.prm
   69787 2020-05-08 17:41 data/resdata.h
 1936876 2020-05-08 17:41 data/rigid-fragments.txt
   24540 2020-05-08 17:41 data/gaff.prm
   10975 2020-05-08 17:41 data/types.txt
    4322 2020-05-08 17:41 data/mmffpbci.par
   53685 2020-05-08 17:41 data/splash.png
     444 2020-05-08 17:41 data/eem.txt
   12192 2020-05-08 17:41 data/mmffstbn.par
     460 2020-05-08 17:41 data/eem2015ha.txt
   18856 2020-05-08 17:41 data/mmffbond.par
     565 2020-05-08 17:41 data/mmff94.ff
   12573 2020-05-08 17:41 data/UFF.prm
  157957 2020-05-08 17:41 data/rigid-fragments-index.txt
    3386 2020-05-08 17:41 data/mpC.txt
   16754 2020-05-08 17:41 data/ghemical.prm
   14158 2020-05-08 17:41 data/mmffchg.par
   10155 2020-05-08 17:41 data/atomtyp.txt
  105886 2020-05-08 17:41 data/space-groups.txt
    4874 2020-05-08 17:41 data/eqeqIonizations.txt
     474 2020-05-08 17:41 data/genheaders.sh
    1308 2020-05-08 17:41 data/mmffdfsb.par
   12284 2020-05-08 17:41 data/bondtyp.h
  758529 2020-05-08 17:41 data/ring-fragments.txt
  690432 2020-05-08 17:41 data/atomization-energies.txt
   23731 2020-05-08 17:41 data/atomtyp.h
    3096 2020-05-08 17:41 data/qeq.txt
     460 2020-05-08 17:41 data/eem2015ba.txt
    9367 2020-05-08 17:41 data/patty.rules
    3756 2020-05-08 17:41 data/patterns.txt
   11165 2020-05-08 17:41 data/mmffdef.par
  100427 2020-05-08 17:41 data/mmffang.par
    8890 2020-05-08 17:41 data/MACCS.txt
    4567 2020-05-08 17:41 data/mmffprop.par
      dir 2016-08-25 09:59 external/rapidjson-1.1.0/
      dir 2020-05-08 17:41 external/coordgen-master/
      dir 2020-05-08 17:41 external/maeparser-v1.2.3/
      dir 2020-03-16 21:26 external/maeparser-v1.2.3/maeparser/
   38435 2020-05-08 17:41 external/maeparser-v1.2.3/maeparser-v1.2.3.tar.gz
    2860 2020-03-16 21:26 external/maeparser-v1.2.3/maeparser/CMakeLists.txt
   11388 2020-03-16 21:26 external/maeparser-v1.2.3/maeparser/MaeBlock.cpp
      dir 2020-03-16 21:26 external/maeparser-v1.2.3/maeparser/.azure-pipelines/
      dir 2020-03-16 21:26 external/maeparser-v1.2.3/maeparser/test/
     518 2020-03-16 21:26 external/maeparser-v1.2.3/maeparser/Writer.hpp
    1004 2020-03-16 21:26 external/maeparser-v1.2.3/maeparser/Reader.hpp
    5874 2020-03-16 21:26 external/maeparser-v1.2.3/maeparser/Buffer.cpp
    9333 2020-03-16 21:26 external/maeparser-v1.2.3/maeparser/MaeParser.hpp
    1997 2020-03-16 21:26 external/maeparser-v1.2.3/maeparser/azure-pipelines.yml
     353 2020-03-16 21:26 external/maeparser-v1.2.3/maeparser/MaeParserConfig.hpp
    2871 2020-03-16 21:26 external/maeparser-v1.2.3/maeparser/README.md
    1035 2020-03-16 21:26 external/maeparser-v1.2.3/maeparser/appveyor.yml
     219 2020-03-16 21:26 external/maeparser-v1.2.3/maeparser/.gitignore
    1971 2020-03-16 21:26 external/maeparser-v1.2.3/maeparser/Reader.cpp
    1879 2020-03-16 21:26 external/maeparser-v1.2.3/maeparser/.clang-format
   23994 2020-03-16 21:26 external/maeparser-v1.2.3/maeparser/MaeParser.cpp
    9929 2020-03-16 21:26 external/maeparser-v1.2.3/maeparser/Buffer.hpp
    1057 2020-03-16 21:26 external/maeparser-v1.2.3/maeparser/LICENSE.txt
     919 2020-03-16 21:26 external/maeparser-v1.2.3/maeparser/.travis.yml
   14537 2020-03-16 21:26 external/maeparser-v1.2.3/maeparser/MaeBlock.hpp
    1617 2020-03-16 21:26 external/maeparser-v1.2.3/maeparser/Writer.cpp
    2776 2020-03-16 21:26 external/maeparser-v1.2.3/maeparser/MaeConstants.hpp
   31348 2020-03-16 21:26 external/maeparser-v1.2.3/maeparser/test/MaeParserTest.cpp
    1170 2020-03-16 21:26 external/maeparser-v1.2.3/maeparser/test/CMakeLists.txt
    7451 2020-03-16 21:26 external/maeparser-v1.2.3/maeparser/test/ReaderTest.cpp
    1807 2020-03-16 21:26 external/maeparser-v1.2.3/maeparser/test/test2.maegz
   10447 2020-03-16 21:26 external/maeparser-v1.2.3/maeparser/test/test.mae
    4591 2020-03-16 21:26 external/maeparser-v1.2.3/maeparser/test/BufferTest.cpp
      79 2020-03-16 21:26 external/maeparser-v1.2.3/maeparser/test/MainTestSuite.cpp
     782 2020-03-16 21:26 external/maeparser-v1.2.3/maeparser/test/TestCommon.hpp
    4837 2020-03-16 21:26 external/maeparser-v1.2.3/maeparser/test/UsageDemo.cpp
   10125 2020-03-16 21:26 external/maeparser-v1.2.3/maeparser/test/MaeBlockTest.cpp
    3403 2020-03-16 21:26 external/maeparser-v1.2.3/maeparser/test/WriterTest.cpp
    1419 2020-03-16 21:26 external/maeparser-v1.2.3/maeparser/.azure-pipelines/vs_build.yml
    2539 2020-03-16 21:26 external/maeparser-v1.2.3/maeparser/.azure-pipelines/mac_build.yml
    1426 2020-03-16 21:26 external/maeparser-v1.2.3/maeparser/.azure-pipelines/linux_build.yml
      dir 2020-05-04 18:00 external/coordgen-master/coordgen/
  154959 2020-05-08 17:41 external/coordgen-master/coordgenlibs-master.tar.gz
    6695 2020-05-04 18:00 external/coordgen-master/coordgen/CoordgenFragmentBuilder.h
    8553 2020-05-04 18:00 external/coordgen-master/coordgen/sketcherMinimizerFragment.h
    2909 2020-05-04 18:00 external/coordgen-master/coordgen/sketcherMinimizerMarchingSquares.h
    7874 2020-05-04 18:00 external/coordgen-master/coordgen/sketcherMinimizerMolecule.cpp
   59660 2020-05-04 18:00 external/coordgen-master/coordgen/CoordgenMinimizer.cpp
    4159 2020-05-04 18:00 external/coordgen-master/coordgen/CMakeLists.txt
    1053 2020-05-04 18:00 external/coordgen-master/coordgen/sketcherMinimizerResidueInteraction.h
    1518 2020-05-04 18:00 external/coordgen-master/coordgen/LICENSE
      dir 2020-05-04 18:00 external/coordgen-master/coordgen/.azure-pipelines/
      dir 2020-05-04 18:00 external/coordgen-master/coordgen/test/
      dir 2020-05-04 18:00 external/coordgen-master/coordgen/cmake/
    2352 2020-05-04 18:00 external/coordgen-master/coordgen/sketcherMaeReading.h
     345 2020-05-04 18:00 external/coordgen-master/coordgen/CoordgenConfig.hpp
  128202 2020-05-04 18:00 external/coordgen-master/coordgen/sketcherMinimizer.cpp
    1394 2020-05-04 18:00 external/coordgen-master/coordgen/sketcherMinimizerStretchInteraction.h
    4827 2020-05-04 18:00 external/coordgen-master/coordgen/sketcherMinimizerBendInteraction.h
    2278 2020-05-04 18:00 external/coordgen-master/coordgen/sketcherMinimizerRing.h
   13358 2020-05-04 18:00 external/coordgen-master/coordgen/sketcherMinimizerFragment.cpp
    4182 2020-05-04 18:00 external/coordgen-master/coordgen/mol_generator.py
    2025 2020-05-04 18:00 external/coordgen-master/coordgen/sketcherMinimizerInteraction.h
   39325 2020-05-04 18:00 external/coordgen-master/coordgen/CoordgenFragmentBuilder.cpp
   12693 2020-05-04 18:00 external/coordgen-master/coordgen/CoordgenMacrocycleBuilder.h
   27079 2020-05-04 18:00 external/coordgen-master/coordgen/project.pbxproj
   18956 2020-05-04 18:00 external/coordgen-master/coordgen/sketcherMinimizer.h
   24240 2020-05-04 18:00 external/coordgen-master/coordgen/sketcherMinimizerMaths.h
    1997 2020-05-04 18:00 external/coordgen-master/coordgen/azure-pipelines.yml
    5258 2020-05-04 18:00 external/coordgen-master/coordgen/README.md
    3201 2020-05-04 18:00 external/coordgen-master/coordgen/sketcherMinimizerEZConstrainInteraction.h
    1099 2020-05-04 18:00 external/coordgen-master/coordgen/appveyor.yml
    1928 2020-05-04 18:00 external/coordgen-master/coordgen/qt_preprocess.mak
    8518 2020-05-04 18:00 external/coordgen-master/coordgen/sketcherMinimizerMarchingSquares.cpp
   52497 2020-05-04 18:00 external/coordgen-master/coordgen/sketcherMinimizerAtom.cpp
    4154 2020-05-04 18:00 external/coordgen-master/coordgen/sketcherMinimizerRing.cpp
      45 2020-05-04 18:00 external/coordgen-master/coordgen/.gitignore
     924 2020-05-04 18:00 external/coordgen-master/coordgen/sketcherMinimizerResidueInteraction.cpp
    3544 2020-05-04 18:00 external/coordgen-master/coordgen/sketcherMinimizerBond.h
     434 2020-05-04 18:00 external/coordgen-master/coordgen/sketcherMinimizerResidue.cpp
   14411 2020-05-04 18:00 external/coordgen-master/coordgen/CoordgenFragmenter.cpp
    1879 2020-05-04 18:00 external/coordgen-master/coordgen/.clang-format
    1226 2020-05-04 18:00 external/coordgen-master/coordgen/sketcherMinimizerConstraintInteraction.h
     483 2020-05-04 18:00 external/coordgen-master/coordgen/CoordgenTemplates.h
  121717 2020-05-04 18:00 external/coordgen-master/coordgen/templates.mae
    6311 2020-05-04 18:00 external/coordgen-master/coordgen/sketcherMinimizerBond.cpp
    2270 2020-05-04 18:00 external/coordgen-master/coordgen/sketcherMinimizerClashInteraction.h
      dir 2020-05-04 18:00 external/coordgen-master/coordgen/project.xcworkspace/
      dir 2020-05-04 18:00 external/coordgen-master/coordgen/example_dir/
   13850 2020-05-04 18:00 external/coordgen-master/coordgen/CoordgenMinimizer.h
   44133 2020-05-04 18:00 external/coordgen-master/coordgen/CoordgenMacrocycleBuilder.cpp
   21044 2020-05-04 18:00 external/coordgen-master/coordgen/qt_makeqmake.mak
    1841 2020-05-04 18:00 external/coordgen-master/coordgen/sketcherMinimizerResidue.h
    9992 2020-05-04 18:00 external/coordgen-master/coordgen/sketcherMinimizerAtom.h
    4555 2020-05-04 18:00 external/coordgen-master/coordgen/CoordgenFragmenter.h
    1272 2020-05-04 18:00 external/coordgen-master/coordgen/.travis.yml
      dir 2020-05-04 18:00 external/coordgen-master/coordgen/xcshareddata/
     717 2020-05-04 18:00 external/coordgen-master/coordgen/Info.plist
  179373 2020-05-04 18:00 external/coordgen-master/coordgen/CoordgenTemplates.cpp
    3854 2020-05-04 18:00 external/coordgen-master/coordgen/sketcherMinimizerMolecule.h
      dir 2020-05-04 18:00 external/coordgen-master/coordgen/xcshareddata/xcschemes/
    4107 2020-05-04 18:00 external/coordgen-master/coordgen/xcshareddata/xcschemes/coordgen_standalone.xcscheme
     771 2020-05-04 18:00 external/coordgen-master/coordgen/example_dir/example.cpp
     610 2020-05-04 18:00 external/coordgen-master/coordgen/example_dir/CMakeLists.txt
      dir 2020-05-04 18:00 external/coordgen-master/coordgen/project.xcworkspace/xcshareddata/
     264 2020-05-04 18:00 external/coordgen-master/coordgen/project.xcworkspace/xcshareddata/WorkspaceSettings.xcsettings
    1023 2020-05-04 18:00 external/coordgen-master/coordgen/cmake/Findmaeparser.cmake
    1515 2020-05-04 18:00 external/coordgen-master/coordgen/cmake/CoordgenUtils.cmake
    1136 2020-05-04 18:00 external/coordgen-master/coordgen/test/CMakeLists.txt
    1664 2020-05-04 18:00 external/coordgen-master/coordgen/test/test.mae
    6109 2020-05-04 18:00 external/coordgen-master/coordgen/test/test_coordgen.cpp
     958 2020-05-04 18:00 external/coordgen-master/coordgen/test/testChirality.mae
    1545 2020-05-04 18:00 external/coordgen-master/coordgen/.azure-pipelines/vs_build.yml
    2625 2020-05-04 18:00 external/coordgen-master/coordgen/.azure-pipelines/mac_build.yml
    1512 2020-05-04 18:00 external/coordgen-master/coordgen/.azure-pipelines/linux_build.yml
     229 2016-08-25 09:59 external/rapidjson-1.1.0/RapidJSON.pc.in
      dir 2016-08-25 09:59 external/rapidjson-1.1.0/docker/
    6265 2016-08-25 09:59 external/rapidjson-1.1.0/CMakeLists.txt
      dir 2016-08-25 09:59 external/rapidjson-1.1.0/test/
      dir 2016-08-25 09:59 external/rapidjson-1.1.0/bin/
      94 2016-08-25 09:59 external/rapidjson-1.1.0/include_dirs.js
    6817 2016-08-25 09:59 external/rapidjson-1.1.0/CHANGELOG.md
    3286 2016-08-25 09:59 external/rapidjson-1.1.0/rapidjson.autopkg
      dir 2016-08-25 09:59 external/rapidjson-1.1.0/example/
      dir 2016-08-25 09:59 external/rapidjson-1.1.0/include/
     104 2016-08-25 09:59 external/rapidjson-1.1.0/.gitmodules
    8913 2016-08-25 09:59 external/rapidjson-1.1.0/readme.md
    3247 2016-08-25 09:59 external/rapidjson-1.1.0/travis-doxygen.sh
    1043 2016-08-25 09:59 external/rapidjson-1.1.0/appveyor.yml
     313 2016-08-25 09:59 external/rapidjson-1.1.0/library.json
     349 2016-08-25 09:59 external/rapidjson-1.1.0/.gitignore
     561 2016-08-25 09:59 external/rapidjson-1.1.0/package.json
     450 2016-08-25 09:59 external/rapidjson-1.1.0/.gitattributes
    8704 2016-08-25 09:59 external/rapidjson-1.1.0/readme.zh-cn.md
      dir 2016-08-25 09:59 external/rapidjson-1.1.0/doc/
    5152 2016-08-25 09:59 external/rapidjson-1.1.0/license.txt
      dir 2016-08-25 09:59 external/rapidjson-1.1.0/CMakeModules/
    3455 2016-08-25 09:59 external/rapidjson-1.1.0/.travis.yml
     200 2016-08-25 09:59 external/rapidjson-1.1.0/RapidJSONConfig.cmake.in
     469 2016-08-25 09:59 external/rapidjson-1.1.0/RapidJSONConfigVersion.cmake.in
      dir 2016-08-25 09:59 external/rapidjson-1.1.0/thirdparty/
      dir 2016-08-25 09:59 external/rapidjson-1.1.0/thirdparty/gtest/
     828 2016-08-25 09:59 external/rapidjson-1.1.0/CMakeModules/FindGTestSrc.cmake
      dir 2016-08-25 09:59 external/rapidjson-1.1.0/doc/misc/
    9604 2016-08-25 09:59 external/rapidjson-1.1.0/doc/schema.zh-cn.md
    1009 2016-08-25 09:59 external/rapidjson-1.1.0/doc/CMakeLists.txt
   19969 2016-08-25 09:59 external/rapidjson-1.1.0/doc/sax.zh-cn.md
      dir 2016-08-25 09:59 external/rapidjson-1.1.0/doc/diagram/
    4804 2016-08-25 09:59 external/rapidjson-1.1.0/doc/features.zh-cn.md
   15294 2016-08-25 09:59 external/rapidjson-1.1.0/doc/dom.zh-cn.md
   21549 2016-08-25 09:59 external/rapidjson-1.1.0/doc/tutorial.zh-cn.md
    9963 2016-08-25 09:59 external/rapidjson-1.1.0/doc/schema.md
  103392 2016-08-25 09:59 external/rapidjson-1.1.0/doc/Doxyfile.in
   14947 2016-08-25 09:59 external/rapidjson-1.1.0/doc/faq.zh-cn.md
   15369 2016-08-25 09:59 external/rapidjson-1.1.0/doc/dom.md
   15285 2016-08-25 09:59 external/rapidjson-1.1.0/doc/faq.md
    6860 2016-08-25 09:59 external/rapidjson-1.1.0/doc/encoding.zh-cn.md
    1236 2016-08-25 09:59 external/rapidjson-1.1.0/doc/performance.zh-cn.md
    8532 2016-08-25 09:59 external/rapidjson-1.1.0/doc/pointer.zh-cn.md
    8882 2016-08-25 09:59 external/rapidjson-1.1.0/doc/pointer.md
    1267 2016-08-25 09:59 external/rapidjson-1.1.0/doc/performance.md
    6709 2016-08-25 09:59 external/rapidjson-1.1.0/doc/encoding.md
   14235 2016-08-25 09:59 external/rapidjson-1.1.0/doc/stream.zh-cn.md
   22305 2016-08-25 09:59 external/rapidjson-1.1.0/doc/internals.md
   21947 2016-08-25 09:59 external/rapidjson-1.1.0/doc/tutorial.md
      dir 2016-08-25 09:59 external/rapidjson-1.1.0/doc/logo/
    5005 2016-08-25 09:59 external/rapidjson-1.1.0/doc/features.md
   20432 2016-08-25 09:59 external/rapidjson-1.1.0/doc/sax.md
   14398 2016-08-25 09:59 external/rapidjson-1.1.0/doc/stream.md
     363 2016-08-25 09:59 external/rapidjson-1.1.0/doc/npm.md
  103471 2016-08-25 09:59 external/rapidjson-1.1.0/doc/Doxyfile.zh-cn.in
    4230 2016-08-25 09:59 external/rapidjson-1.1.0/doc/logo/rapidjson.svg
    5259 2016-08-25 09:59 external/rapidjson-1.1.0/doc/logo/rapidjson.png
   43670 2016-08-25 09:59 external/rapidjson-1.1.0/doc/diagram/simpledom.png
   16081 2016-08-25 09:59 external/rapidjson-1.1.0/doc/diagram/move1.png
   99993 2016-08-25 09:59 external/rapidjson-1.1.0/doc/diagram/utilityclass.png
    1456 2016-08-25 09:59 external/rapidjson-1.1.0/doc/diagram/tutorial.dot
   41517 2016-08-25 09:59 external/rapidjson-1.1.0/doc/diagram/move2.png
   36371 2016-08-25 09:59 external/rapidjson-1.1.0/doc/diagram/move3.png
     176 2016-08-25 09:59 external/rapidjson-1.1.0/doc/diagram/makefile
    1435 2016-08-25 09:59 external/rapidjson-1.1.0/doc/diagram/simpledom.dot
    1498 2016-08-25 09:59 external/rapidjson-1.1.0/doc/diagram/move2.dot
    1450 2016-08-25 09:59 external/rapidjson-1.1.0/doc/diagram/move3.dot
     935 2016-08-25 09:59 external/rapidjson-1.1.0/doc/diagram/move1.dot
   44634 2016-08-25 09:59 external/rapidjson-1.1.0/doc/diagram/tutorial.png
    1775 2016-08-25 09:59 external/rapidjson-1.1.0/doc/diagram/utilityclass.dot
    1915 2016-08-25 09:59 external/rapidjson-1.1.0/doc/diagram/iterative-parser-states-diagram.dot
    2239 2016-08-25 09:59 external/rapidjson-1.1.0/doc/diagram/insituparsing.dot
    1427 2016-08-25 09:59 external/rapidjson-1.1.0/doc/diagram/normalparsing.dot
     912 2016-08-25 09:59 external/rapidjson-1.1.0/doc/diagram/architecture.dot
   92378 2016-08-25 09:59 external/rapidjson-1.1.0/doc/diagram/iterative-parser-states-diagram.png
   37281 2016-08-25 09:59 external/rapidjson-1.1.0/doc/diagram/insituparsing.png
   16569 2016-08-25 09:59 external/rapidjson-1.1.0/doc/diagram/architecture.png
   32887 2016-08-25 09:59 external/rapidjson-1.1.0/doc/diagram/normalparsing.png
    6090 2016-08-25 09:59 external/rapidjson-1.1.0/doc/misc/DoxygenLayout.xml
     256 2016-08-25 09:59 external/rapidjson-1.1.0/doc/misc/footer.html
    6572 2016-08-25 09:59 external/rapidjson-1.1.0/doc/misc/doxygenextra.css
    1137 2016-08-25 09:59 external/rapidjson-1.1.0/doc/misc/header.html
      dir 2016-08-25 09:59 external/rapidjson-1.1.0/include/rapidjson/
    4035 2016-08-25 09:59 external/rapidjson-1.1.0/include/rapidjson/fwd.h
    2667 2016-08-25 09:59 external/rapidjson-1.1.0/include/rapidjson/memorystream.h
   79760 2016-08-25 09:59 external/rapidjson-1.1.0/include/rapidjson/reader.h
    9601 2016-08-25 09:59 external/rapidjson-1.1.0/include/rapidjson/prettywriter.h
    2331 2016-08-25 09:59 external/rapidjson-1.1.0/include/rapidjson/ostreamwrapper.h
   10686 2016-08-25 09:59 external/rapidjson-1.1.0/include/rapidjson/encodedstream.h
    2988 2016-08-25 09:59 external/rapidjson-1.1.0/include/rapidjson/filereadstream.h
    3576 2016-08-25 09:59 external/rapidjson-1.1.0/include/rapidjson/istreamwrapper.h
    3798 2016-08-25 09:59 external/rapidjson-1.1.0/include/rapidjson/stringbuffer.h
      dir 2016-08-25 09:59 external/rapidjson-1.1.0/include/rapidjson/internal/
   28553 2016-08-25 09:59 external/rapidjson-1.1.0/include/rapidjson/encodings.h
   80014 2016-08-25 09:59 external/rapidjson-1.1.0/include/rapidjson/schema.h
    5466 2016-08-25 09:59 external/rapidjson-1.1.0/include/rapidjson/stream.h
    3139 2016-08-25 09:59 external/rapidjson-1.1.0/include/rapidjson/filewritestream.h
   21461 2016-08-25 09:59 external/rapidjson-1.1.0/include/rapidjson/rapidjson.h
  113794 2016-08-25 09:59 external/rapidjson-1.1.0/include/rapidjson/document.h
   10311 2016-08-25 09:59 external/rapidjson-1.1.0/include/rapidjson/allocators.h
   23261 2016-08-25 09:59 external/rapidjson-1.1.0/include/rapidjson/writer.h
      dir 2016-08-25 09:59 external/rapidjson-1.1.0/include/rapidjson/error/
    2560 2016-08-25 09:59 external/rapidjson-1.1.0/include/rapidjson/memorybuffer.h
   58465 2016-08-25 09:59 external/rapidjson-1.1.0/include/rapidjson/pointer.h
      dir 2016-08-25 09:59 external/rapidjson-1.1.0/include/rapidjson/msinttypes/
    8372 2016-08-25 09:59 external/rapidjson-1.1.0/include/rapidjson/msinttypes/inttypes.h
    9386 2016-08-25 09:59 external/rapidjson-1.1.0/include/rapidjson/msinttypes/stdint.h
    5824 2016-08-25 09:59 external/rapidjson-1.1.0/include/rapidjson/error/error.h
    3870 2016-08-25 09:59 external/rapidjson-1.1.0/include/rapidjson/error/en.h
    3022 2016-08-25 09:59 external/rapidjson-1.1.0/include/rapidjson/internal/ieee754.h
    8672 2016-08-25 09:59 external/rapidjson-1.1.0/include/rapidjson/internal/strtod.h
    1419 2016-08-25 09:59 external/rapidjson-1.1.0/include/rapidjson/internal/swap.h
   24825 2016-08-25 09:59 external/rapidjson-1.1.0/include/rapidjson/internal/regex.h
   11512 2016-08-25 09:59 external/rapidjson-1.1.0/include/rapidjson/internal/diyfp.h
    9139 2016-08-25 09:59 external/rapidjson-1.1.0/include/rapidjson/internal/biginteger.h
    1897 2016-08-25 09:59 external/rapidjson-1.1.0/include/rapidjson/internal/strfunc.h
   10306 2016-08-25 09:59 external/rapidjson-1.1.0/include/rapidjson/internal/itoa.h
    7026 2016-08-25 09:59 external/rapidjson-1.1.0/include/rapidjson/internal/stack.h
    8172 2016-08-25 09:59 external/rapidjson-1.1.0/include/rapidjson/internal/dtoa.h
    6572 2016-08-25 09:59 external/rapidjson-1.1.0/include/rapidjson/internal/meta.h
    3595 2016-08-25 09:59 external/rapidjson-1.1.0/include/rapidjson/internal/pow10.h
      dir 2016-08-25 09:59 external/rapidjson-1.1.0/example/simpledom/
      dir 2016-08-25 09:59 external/rapidjson-1.1.0/example/tutorial/
      dir 2016-08-25 09:59 external/rapidjson-1.1.0/example/prettyauto/
    1021 2016-08-25 09:59 external/rapidjson-1.1.0/example/CMakeLists.txt
      dir 2016-08-25 09:59 external/rapidjson-1.1.0/example/messagereader/
      dir 2016-08-25 09:59 external/rapidjson-1.1.0/example/parsebyparts/
      dir 2016-08-25 09:59 external/rapidjson-1.1.0/example/filterkeydom/
      dir 2016-08-25 09:59 external/rapidjson-1.1.0/example/simplewriter/
      dir 2016-08-25 09:59 external/rapidjson-1.1.0/example/serialize/
      dir 2016-08-25 09:59 external/rapidjson-1.1.0/example/filterkey/
      dir 2016-08-25 09:59 external/rapidjson-1.1.0/example/jsonx/
      dir 2016-08-25 09:59 external/rapidjson-1.1.0/example/pretty/
      dir 2016-08-25 09:59 external/rapidjson-1.1.0/example/condense/
      dir 2016-08-25 09:59 external/rapidjson-1.1.0/example/simplereader/
      dir 2016-08-25 09:59 external/rapidjson-1.1.0/example/capitalize/
      dir 2016-08-25 09:59 external/rapidjson-1.1.0/example/schemavalidator/
    2510 2016-08-25 09:59 external/rapidjson-1.1.0/example/schemavalidator/schemavalidator.cpp
    2577 2016-08-25 09:59 external/rapidjson-1.1.0/example/capitalize/capitalize.cpp
    1868 2016-08-25 09:59 external/rapidjson-1.1.0/example/simplereader/simplereader.cpp
    1015 2016-08-25 09:59 external/rapidjson-1.1.0/example/condense/condense.cpp
    1019 2016-08-25 09:59 external/rapidjson-1.1.0/example/pretty/pretty.cpp
    6022 2016-08-25 09:59 external/rapidjson-1.1.0/example/jsonx/jsonx.cpp
    4979 2016-08-25 09:59 external/rapidjson-1.1.0/example/filterkey/filterkey.cpp
    4590 2016-08-25 09:59 external/rapidjson-1.1.0/example/serialize/serialize.cpp
    1031 2016-08-25 09:59 external/rapidjson-1.1.0/example/simplewriter/simplewriter.cpp
    5946 2016-08-25 09:59 external/rapidjson-1.1.0/example/filterkeydom/filterkeydom.cpp
    5026 2016-08-25 09:59 external/rapidjson-1.1.0/example/parsebyparts/parsebyparts.cpp
    2814 2016-08-25 09:59 external/rapidjson-1.1.0/example/messagereader/messagereader.cpp
    2245 2016-08-25 09:59 external/rapidjson-1.1.0/example/prettyauto/prettyauto.cpp
    6263 2016-08-25 09:59 external/rapidjson-1.1.0/example/tutorial/tutorial.cpp
     685 2016-08-25 09:59 external/rapidjson-1.1.0/example/simpledom/simpledom.cpp
      dir 2016-08-25 09:59 external/rapidjson-1.1.0/bin/encodings/
      dir 2016-08-25 09:59 external/rapidjson-1.1.0/bin/types/
      dir 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonchecker/
      dir 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/
      dir 2016-08-25 09:59 external/rapidjson-1.1.0/bin/draft-04/
      dir 2016-08-25 09:59 external/rapidjson-1.1.0/bin/data/
     626 2016-08-25 09:59 external/rapidjson-1.1.0/bin/data/widget.json
     603 2016-08-25 09:59 external/rapidjson-1.1.0/bin/data/glossary.json
     898 2016-08-25 09:59 external/rapidjson-1.1.0/bin/data/menu.json
  687491 2016-08-25 09:59 external/rapidjson-1.1.0/bin/data/sample.json
     103 2016-08-25 09:59 external/rapidjson-1.1.0/bin/data/readme.txt
    3554 2016-08-25 09:59 external/rapidjson-1.1.0/bin/data/webapp.json
    4375 2016-08-25 09:59 external/rapidjson-1.1.0/bin/draft-04/schema
    1057 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/LICENSE
      dir 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/bin/
      dir 2020-05-08 17:55 external/rapidjson-1.1.0/bin/jsonschema/tests/
    4787 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/README.md
      dir 2020-05-08 17:55 external/rapidjson-1.1.0/bin/jsonschema/remotes/
       5 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/.gitignore
     134 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/tox.ini
      98 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/.travis.yml
      dir 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/remotes/folder/
     110 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/remotes/subSchemas.json
      25 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/remotes/integer.json
      25 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/remotes/folder/folderInteger.json
      dir 2020-05-08 17:55 external/rapidjson-1.1.0/bin/jsonschema/tests/draft4/
      dir 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/tests/draft3/
    2613 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/tests/draft3/uniqueItems.json
     693 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/tests/draft3/minItems.json
    2591 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/tests/draft3/extends.json
    2745 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/tests/draft3/additionalProperties.json
    2989 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/tests/draft3/dependencies.json
    1136 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/tests/draft3/items.json
    1964 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/tests/draft3/enum.json
    2881 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/tests/draft3/properties.json
     895 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/tests/draft3/maxLength.json
    1063 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/tests/draft3/minimum.json
      dir 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/tests/draft3/optional/
    2257 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/tests/draft3/additionalItems.json
     857 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/tests/draft3/pattern.json
    1282 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/tests/draft3/required.json
   13217 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/tests/draft3/type.json
    1273 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/tests/draft3/default.json
    3365 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/tests/draft3/patternProperties.json
    1961 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/tests/draft3/refRemote.json
    4385 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/tests/draft3/ref.json
    1063 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/tests/draft3/maximum.json
    1936 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/tests/draft3/disallow.json
     886 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/tests/draft3/minLength.json
     706 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/tests/draft3/maxItems.json
    1544 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/tests/draft3/divisibleBy.json
     384 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/tests/draft3/optional/zeroTerminatedFloats.json
    3075 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/tests/draft3/optional/bignum.json
     463 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/tests/draft3/optional/jsregex.json
    6751 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/tests/draft3/optional/format.json
    2613 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/tests/draft4/uniqueItems.json
     693 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/tests/draft4/minItems.json
    2745 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/tests/draft4/additionalProperties.json
    3139 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/tests/draft4/dependencies.json
    1608 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/tests/draft4/anyOf.json
    2266 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/tests/draft4/not.json
    1136 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/tests/draft4/items.json
    1975 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/tests/draft4/enum.json
     725 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/tests/draft4/minProperties.json
    2881 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/tests/draft4/properties.json
     896 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/tests/draft4/maxLength.json
    1063 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/tests/draft4/minimum.json
      dir 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/tests/draft4/optional/
    1607 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/tests/draft4/oneOf.json
    2282 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/tests/draft4/additionalItems.json
     857 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/tests/draft4/pattern.json
     854 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/tests/draft4/definitions.json
     759 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/tests/draft4/maxProperties.json
     923 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/tests/draft4/required.json
    9298 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/tests/draft4/type.json
    1273 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/tests/draft4/default.json
    1525 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/tests/draft4/multipleOf.json
    3365 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/tests/draft4/patternProperties.json
    1961 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/tests/draft4/refRemote.json
    3025 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/tests/draft4/allOf.json
    4366 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/tests/draft4/ref.json
    1063 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/tests/draft4/maximum.json
     886 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/tests/draft4/minLength.json
     706 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/tests/draft4/maxItems.json
     384 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/tests/draft4/optional/zeroTerminatedFloats.json
    3075 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/tests/draft4/optional/bignum.json
    4608 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/tests/draft4/optional/format.json
    9059 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonschema/bin/jsonschema_suite
      37 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonchecker/fail3.json
      31 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonchecker/fail12.json
      15 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonchecker/fail28.json
      16 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonchecker/fail24.json
      40 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonchecker/fail32.json
      12 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonchecker/fail33.json
      29 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonchecker/fail25.json
       4 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonchecker/fail29.json
      43 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonchecker/fail13.json
      17 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonchecker/fail2.json
      22 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonchecker/fail9.json
      50 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonchecker/fail18.json
      33 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonchecker/fail22.json
      24 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonchecker/fail5.json
      31 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonchecker/fail14.json
    1441 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonchecker/pass1.json
      34 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonchecker/fail15.json
      16 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonchecker/fail4.json
      20 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonchecker/fail23.json
      22 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonchecker/fail19.json
      16 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonchecker/fail8.json
      23 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonchecker/fail20.json
     148 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonchecker/pass3.json
       8 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonchecker/fail16.json
      26 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonchecker/fail7.json
      26 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonchecker/fail6.json
      34 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonchecker/fail17.json
      52 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonchecker/pass2.json
      32 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonchecker/fail21.json
     173 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonchecker/readme.txt
      58 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonchecker/fail10.json
      60 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonchecker/fail1.json
       5 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonchecker/fail30.json
      38 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonchecker/fail26.json
      14 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonchecker/fail27.json
       7 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonchecker/fail31.json
      29 2016-08-25 09:59 external/rapidjson-1.1.0/bin/jsonchecker/fail11.json
   33764 2016-08-25 09:59 external/rapidjson-1.1.0/bin/types/paragraphs.json
    4202 2016-08-25 09:59 external/rapidjson-1.1.0/bin/types/guids.json
   15142 2016-08-25 09:59 external/rapidjson-1.1.0/bin/types/mixed.json
    1098 2016-08-25 09:59 external/rapidjson-1.1.0/bin/types/integers.json
     802 2016-08-25 09:59 external/rapidjson-1.1.0/bin/types/nulls.json
      86 2016-08-25 09:59 external/rapidjson-1.1.0/bin/types/readme.txt
     849 2016-08-25 09:59 external/rapidjson-1.1.0/bin/types/booleans.json
    1698 2016-08-25 09:59 external/rapidjson-1.1.0/bin/types/floats.json
     370 2016-08-25 09:59 external/rapidjson-1.1.0/bin/encodings/utf16lebom.json
     740 2016-08-25 09:59 external/rapidjson-1.1.0/bin/encodings/utf32bebom.json
     736 2016-08-25 09:59 external/rapidjson-1.1.0/bin/encodings/utf32le.json
     368 2016-08-25 09:59 external/rapidjson-1.1.0/bin/encodings/utf16le.json
     322 2016-08-25 09:59 external/rapidjson-1.1.0/bin/encodings/utf8.json
     736 2016-08-25 09:59 external/rapidjson-1.1.0/bin/encodings/utf32be.json
     368 2016-08-25 09:59 external/rapidjson-1.1.0/bin/encodings/utf16be.json
     325 2016-08-25 09:59 external/rapidjson-1.1.0/bin/encodings/utf8bom.json
     370 2016-08-25 09:59 external/rapidjson-1.1.0/bin/encodings/utf16bebom.json
     740 2016-08-25 09:59 external/rapidjson-1.1.0/bin/encodings/utf32lebom.json
      dir 2016-08-25 09:59 external/rapidjson-1.1.0/test/unittest/
     491 2016-08-25 09:59 external/rapidjson-1.1.0/test/CMakeLists.txt
      dir 2016-08-25 09:59 external/rapidjson-1.1.0/test/perftest/
     765 2016-08-25 09:59 external/rapidjson-1.1.0/test/perftest/CMakeLists.txt
   12440 2016-08-25 09:59 external/rapidjson-1.1.0/test/perftest/rapidjsontest.cpp
     996 2016-08-25 09:59 external/rapidjson-1.1.0/test/perftest/perftest.cpp
    4476 2016-08-25 09:59 external/rapidjson-1.1.0/test/perftest/platformtest.cpp
   35486 2016-08-25 09:59 external/rapidjson-1.1.0/test/perftest/misctest.cpp
    5643 2016-08-25 09:59 external/rapidjson-1.1.0/test/perftest/perftest.h
    7095 2016-08-25 09:59 external/rapidjson-1.1.0/test/perftest/schematest.cpp
   12025 2016-08-25 09:59 external/rapidjson-1.1.0/test/unittest/encodedstreamtest.cpp
    3156 2016-08-25 09:59 external/rapidjson-1.1.0/test/unittest/CMakeLists.txt
    2459 2016-08-25 09:59 external/rapidjson-1.1.0/test/unittest/ostreamwrappertest.cpp
    4273 2016-08-25 09:59 external/rapidjson-1.1.0/test/unittest/strtodtest.cpp
    3966 2016-08-25 09:59 external/rapidjson-1.1.0/test/unittest/itoatest.cpp
   16157 2016-08-25 09:59 external/rapidjson-1.1.0/test/unittest/regextest.cpp
    3218 2016-08-25 09:59 external/rapidjson-1.1.0/test/unittest/filestreamtest.cpp
   70515 2016-08-25 09:59 external/rapidjson-1.1.0/test/unittest/readertest.cpp
    3403 2016-08-25 09:59 external/rapidjson-1.1.0/test/unittest/dtoatest.cpp
    3308 2016-08-25 09:59 external/rapidjson-1.1.0/test/unittest/allocatorstest.cpp
   55407 2016-08-25 09:59 external/rapidjson-1.1.0/test/unittest/pointertest.cpp
    3766 2016-08-25 09:59 external/rapidjson-1.1.0/test/unittest/unittest.h
    6920 2016-08-25 09:59 external/rapidjson-1.1.0/test/unittest/simdtest.cpp
    3178 2016-08-25 09:59 external/rapidjson-1.1.0/test/unittest/jsoncheckertest.cpp
   19364 2016-08-25 09:59 external/rapidjson-1.1.0/test/unittest/encodingstest.cpp
    1337 2016-08-25 09:59 external/rapidjson-1.1.0/test/unittest/strfunctest.cpp
   54940 2016-08-25 09:59 external/rapidjson-1.1.0/test/unittest/valuetest.cpp
    4834 2016-08-25 09:59 external/rapidjson-1.1.0/test/unittest/stringbuffertest.cpp
    5373 2016-08-25 09:59 external/rapidjson-1.1.0/test/unittest/istreamwrappertest.cpp
    5744 2016-08-25 09:59 external/rapidjson-1.1.0/test/unittest/fwdtest.cpp
   14988 2016-08-25 09:59 external/rapidjson-1.1.0/test/unittest/writertest.cpp
    2422 2016-08-25 09:59 external/rapidjson-1.1.0/test/unittest/namespacetest.cpp
   47377 2016-08-25 09:59 external/rapidjson-1.1.0/test/unittest/schematest.cpp
   20694 2016-08-25 09:59 external/rapidjson-1.1.0/test/unittest/documenttest.cpp
    1548 2016-08-25 09:59 external/rapidjson-1.1.0/test/unittest/unittest.cpp
    4221 2016-08-25 09:59 external/rapidjson-1.1.0/test/unittest/bigintegertest.cpp
    5766 2016-08-25 09:59 external/rapidjson-1.1.0/test/unittest/prettywritertest.cpp
      dir 2016-08-25 09:59 external/rapidjson-1.1.0/docker/debian/
     229 2016-08-25 09:59 external/rapidjson-1.1.0/docker/debian/Dockerfile
    5444 2020-05-08 17:41 doc/README.povray
    3471 2020-05-08 17:41 doc/obprop.html
    9454 2020-05-08 17:41 doc/obabel.1
    1850 2020-05-08 17:41 doc/obconformer.1
    2099 2020-05-08 17:41 doc/obgen.1
    1665 2020-05-08 17:41 doc/obgui.html
    1247 2020-05-08 17:41 doc/CMakeLists.txt
    4054 2020-05-08 17:41 doc/obminimize.html
    1388 2020-05-08 17:41 doc/obdistgen.1
    2312 2020-05-08 17:41 doc/obfit.1
      dir 2020-05-08 17:41 doc/images/
    2902 2020-05-08 17:41 doc/obgrep.1
    2131 2020-05-08 17:41 doc/obenergy.1
    1376 2020-05-08 17:41 doc/obsym.1
    3576 2020-05-08 17:41 doc/obenergy.html
   77826 2020-05-08 17:41 doc/Doxyfile.in
    3173 2020-05-08 17:41 doc/obrotate.1
    1650 2020-05-08 17:41 doc/roundtrip.1
    7099 2020-05-08 17:41 doc/OpenBabelGUI.html
    2350 2020-05-08 17:41 doc/obrms.1
    9316 2020-05-08 17:41 doc/OBTwoMigration.html
    3620 2020-05-08 17:41 doc/obfit.html
 1754107 2020-05-08 17:41 doc/openbabel.tags
    2250 2020-05-08 17:41 doc/obprobe.1
    3012 2020-05-08 17:41 doc/obrotamer.html
  165517 2020-05-08 17:41 doc/dioxin.png
     231 2020-05-08 17:41 doc/modules.h
   53685 2020-05-08 17:41 doc/splash.png
    4458 2020-05-08 17:41 doc/obspectrophore.html
    1574 2020-05-08 17:41 doc/obchiral.1
      dir 2020-05-08 17:41 doc/examples/
    1766 2020-05-08 17:41 doc/obrotamer.1
     267 2020-05-08 17:41 doc/README.dioxin.pov
    4662 2020-05-08 17:41 doc/obrotate.html
    4572 2020-05-08 17:41 doc/obgrep.html
    3064 2020-05-08 17:41 doc/obspectrophore.1
     826 2020-05-08 17:41 doc/api-footer.html
    2097 2020-05-08 17:41 doc/obprop.1
   12671 2020-05-08 17:41 doc/obabel.html
    2365 2020-05-08 17:41 doc/dioxin.mol2
     731 2020-05-08 17:41 doc/obgui.1
    2786 2020-05-08 17:41 doc/obchiral.html
   20210 2020-05-08 17:41 doc/dioxin.inc
    1688 2020-05-08 17:41 doc/obthermo.1
     521 2020-05-08 17:41 doc/api-header.html
    3124 2020-05-08 17:41 doc/obconformer.html
   10777 2020-05-08 17:41 doc/FAQ.html
     437 2020-05-08 17:41 doc/dioxin.pov
    3649 2020-05-08 17:41 doc/obprobe.html
    2498 2020-05-08 17:41 doc/obminimize.1
    3501 2020-05-08 17:41 doc/obgen.html
    1412 2020-05-08 17:41 doc/obtautomer.1
     333 2020-05-08 17:41 doc/examples/CMakeLists.txt
     363 2020-05-08 17:41 doc/examples/obconversion_readstring.py
     445 2020-05-08 17:41 doc/examples/obconversion_readstring.cpp
    1292 2020-05-08 17:41 doc/examples/obfingerprint_getfingerprint.cpp
    2248 2020-05-08 17:41 doc/examples/obconformersearch_default.cpp
      dir 2020-05-08 17:41 doc/examples/static_executable/
    1589 2020-05-08 17:41 doc/examples/obforcefield_energy.cpp
    2457 2020-05-08 17:41 doc/examples/static_executable/CMakeLists.txt
     759 2020-05-08 17:41 doc/examples/static_executable/myexe.cpp
    7473 2020-05-08 17:41 doc/images/cistrans.png
    8751 2020-05-08 17:41 doc/images/squareplanar.png
   32519 2020-05-08 17:41 doc/images/energyconformerscore.png
   45384 2020-05-08 17:41 doc/images/rmsdconformerscore.png
   14583 2020-05-08 17:41 doc/images/tetrahedral.png
   25167 2020-05-08 17:41 doc/images/tetraplanar.png
    1336 2020-05-08 17:41 doc/images/gettransref.png
    1296 2020-05-08 17:41 doc/images/getcisref.png
   58528 2020-05-08 17:41 doc/images/SPshapes.png
   37222 2020-05-08 17:41 doc/images/spectrophore_cage.png
   49089 2020-05-08 17:41 doc/images/tetranonplanar.png
   33115 2020-05-08 17:41 scripts/openbabel-csharp.i
   13808 2020-05-08 17:41 scripts/openbabel-java.i
   24083 2020-05-08 17:41 scripts/CMakeLists.txt
   15050 2020-05-08 17:41 scripts/openbabel-R.i
    3601 2020-05-08 17:41 scripts/stereo.i
      dir 2020-05-08 17:41 scripts/python/
      dir 2020-05-08 17:47 scripts/perl/
      dir 2020-05-08 17:41 scripts/R/
   10991 2020-05-08 17:41 scripts/openbabel-php.i
      dir 2020-05-08 17:46 scripts/java/
      dir 2020-05-08 17:41 scripts/php/
   10573 2020-05-08 17:41 scripts/openbabel-perl.i
   10698 2020-05-08 17:41 scripts/openbabel-mono.i
    9599 2020-05-08 17:41 scripts/openbabel-ruby.i
      dir 2020-05-08 17:41 scripts/scala/
      dir 2020-05-08 17:48 scripts/csharp/
      dir 2020-05-08 17:46 scripts/ruby/
   18932 2020-05-08 17:41 scripts/openbabel-python.i
    3826 2020-05-08 17:41 scripts/ruby/README
      dir 2020-05-08 17:41 scripts/ruby/examples/
    1478 2020-05-08 17:41 scripts/ruby/extconf.rb
 5019603 2020-05-08 17:46 scripts/ruby/openbabel-ruby.cpp
     342 2020-05-08 17:41 scripts/ruby/examples/load_benzene.rb
     514 2020-05-08 17:41 scripts/ruby/examples/canonical_smiles.rb
    1320 2020-05-08 17:41 scripts/csharp/OBDotNetAssemblyInfo.cs
 1130381 2020-05-08 17:48 scripts/csharp/openbabel-csharp.cpp
  527360 2020-05-08 17:48 scripts/csharp/OBDotNet.dll
     596 2020-05-08 17:41 scripts/csharp/obdotnet.snk
     554 2020-05-08 17:41 scripts/scala/README
     552 2020-05-08 17:41 scripts/scala/OBTest.scala
      dir 2020-05-08 17:41 scripts/php/example/
   14903 2020-05-08 17:41 scripts/php/baphpel.php
     560 2020-05-08 17:41 scripts/php/example/example1.php
  601645 2020-05-08 17:46 scripts/java/openbabel.jar
    1662 2020-05-08 17:41 scripts/java/README
     475 2020-05-08 17:41 scripts/java/OBTest.java
 1919011 2020-05-08 17:46 scripts/java/openbabel-java.cpp
    2439 2020-05-08 17:41 scripts/R/README
      dir 2020-05-08 17:41 scripts/R/examples/
    1149 2020-05-08 17:41 scripts/R/examples/test.R
      dir 2020-05-08 17:41 scripts/R/examples/openbabelR/
      dir 2020-05-08 17:41 scripts/R/examples/openbabelR/R/
      25 2020-05-08 17:41 scripts/R/examples/openbabelR/NAMESPACE
     222 2020-05-08 17:41 scripts/R/examples/openbabelR/DESCRIPTION
      dir 2020-05-08 17:41 scripts/R/examples/openbabelR/src/
 4445500 2020-05-08 17:41 scripts/R/examples/openbabelR/src/openbabel-R.cpp
     125 2020-05-08 17:41 scripts/R/examples/openbabelR/src/Makevars
     112 2020-05-08 17:41 scripts/R/examples/openbabelR/R/init.R
      dir 2020-05-08 17:41 scripts/perl/inc/
  251184 2020-05-08 17:47 scripts/perl/OpenBabel.pm
     658 2020-05-08 17:41 scripts/perl/Changes
     866 2020-05-08 17:41 scripts/perl/MANIFEST
      dir 2020-05-08 17:41 scripts/perl/t/
    2244 2020-05-08 17:41 scripts/perl/README
   17992 2020-05-08 17:41 scripts/perl/COPYING
      dir 2020-05-08 17:41 scripts/perl/examples/
     295 2020-05-08 17:41 scripts/perl/META.yml
    1467 2020-05-08 17:41 scripts/perl/Makefile.PL
 4496129 2020-05-08 17:47 scripts/perl/openbabel-perl.cpp
     588 2020-05-08 17:41 scripts/perl/examples/example.pl
    1013 2020-05-08 17:41 scripts/perl/t/internalcoord.t
     733 2020-05-08 17:41 scripts/perl/t/data.t
    1359 2020-05-08 17:41 scripts/perl/t/mol.t
    1512 2020-05-08 17:41 scripts/perl/t/conversion.t
    1506 2020-05-08 17:41 scripts/perl/t/atom.t
     830 2020-05-08 17:41 scripts/perl/t/residue.t
     850 2020-05-08 17:41 scripts/perl/t/format.t
    1080 2020-05-08 17:41 scripts/perl/t/bond.t
      dir 2020-05-08 17:41 scripts/perl/inc/Devel/
    8314 2020-05-08 17:41 scripts/perl/inc/Devel/CheckLib.pm
      dir 2020-05-08 17:46 scripts/python/openbabel/
     133 2020-05-08 17:41 scripts/python/MANIFEST.in
    6245 2020-05-08 17:41 scripts/python/setup.py
   34343 2020-05-08 17:41 scripts/python/pybelapi.html
      dir 2020-05-08 17:41 scripts/python/examples/
    3297 2020-05-08 17:41 scripts/python/Examples.html
    2809 2020-05-08 17:41 scripts/python/README.rst
    1436 2020-05-08 17:41 scripts/python/examples/minSimple.py
   17385 2020-05-08 17:41 scripts/python/examples/testpybel.py
    1195 2020-05-08 17:41 scripts/python/examples/energy.py
     689 2020-05-08 17:41 scripts/python/examples/examples.py
  269694 2020-05-08 17:41 scripts/python/examples/hashizume.cif
   45308 2020-05-08 17:41 scripts/python/examples/dalke_test.py
    1688 2020-05-08 17:41 scripts/python/examples/wgtRotorSrch.py
     486 2020-05-08 17:41 scripts/python/examples/findcoverage.bat
    4316 2020-05-08 17:41 scripts/python/examples/head.sdf
  283096 2020-05-08 17:46 scripts/python/openbabel/openbabel.py
     527 2020-05-08 17:42 scripts/python/openbabel/__init__.py
   34668 2020-05-08 17:41 scripts/python/openbabel/pybel.py
     538 2020-05-08 17:41 scripts/python/openbabel/__init__.py.in
 4530394 2020-05-08 17:46 scripts/python/openbabel/openbabel-python.cpp
      dir 2020-05-08 17:41 include/inchi/
   46675 2020-05-08 17:41 include/chemdrawcdx.h
     958 2020-05-08 17:41 include/CMakeLists.txt
      dir 2020-05-08 17:41 include/libxml/
     297 2020-05-08 17:41 include/RDKitConv.h
      dir 2020-05-08 17:41 include/openbabel/
   55177 2020-05-08 17:41 include/inchi_api.h
    5765 2020-05-08 17:41 include/LBFGS.h
    4771 2020-05-08 17:41 include/iconv.h
   66188 2020-05-08 17:41 include/zlib.h
      dir 2020-05-08 17:41 include/OB-BGL/
    9544 2020-05-08 17:41 include/zconf.h
      dir 2020-05-08 17:41 include/LBFGS/
    4239 2020-05-08 17:41 include/LBFGS/LineSearchBracketing.h
    6264 2020-05-08 17:41 include/LBFGS/LineSearchNocedalWright.h
    7743 2020-05-08 17:41 include/LBFGS/Param.h
    3893 2020-05-08 17:41 include/LBFGS/LineSearchBacktracking.h
    5574 2020-05-08 17:41 include/OB-BGL/example.cpp
   11261 2020-05-08 17:41 include/OB-BGL/mol_graph.h
    4432 2020-05-08 17:41 include/OB-BGL/verbose_visitors.h
   41296 2020-05-08 17:41 include/openbabel/generic.h
   24896 2020-05-08 17:41 include/openbabel/conformersearch.h
      dir 2020-05-08 17:41 include/openbabel/tree/
    9014 2020-05-08 17:41 include/openbabel/oberror.h
    4914 2020-05-08 17:41 include/openbabel/chargemodel.h
   11398 2020-05-08 17:41 include/openbabel/chains.h
   16139 2020-05-08 17:41 include/openbabel/isomorphism.h
   19909 2020-05-08 17:41 include/openbabel/obconversion.h
    5561 2020-05-08 17:41 include/openbabel/op.h
      dir 2020-05-08 17:41 include/openbabel/stereo/
   21285 2020-05-08 17:41 include/openbabel/plugin.h
    3241 2020-05-08 17:41 include/openbabel/text.h
    2991 2020-05-08 17:41 include/openbabel/groupcontrib.h
    4128 2020-05-08 17:41 include/openbabel/dlhandler.h
    4440 2020-05-08 17:41 include/openbabel/alias.h
    9165 2020-05-08 17:41 include/openbabel/query.h
    1520 2020-05-08 17:41 include/openbabel/locale.h
    2819 2020-05-08 17:41 include/openbabel/internalcoord.h
    2412 2020-05-08 17:41 include/openbabel/optransform.h
   12291 2020-05-08 17:41 include/openbabel/elements.h
    7380 2020-05-08 17:41 include/openbabel/obmolecformat.h
   16216 2020-05-08 17:41 include/openbabel/obiter.h
    8091 2020-05-08 17:41 include/openbabel/reactionfacade.h
    6697 2020-05-08 17:41 include/openbabel/ring.h
   10811 2020-05-08 17:41 include/openbabel/data.h
    2424 2020-05-08 17:41 include/openbabel/graphsym.h
   38362 2020-05-08 17:41 include/openbabel/mol.h
    4516 2020-05-08 17:41 include/openbabel/tautomer.h
    5076 2020-05-08 17:41 include/openbabel/descriptor.h
   26169 2020-05-08 17:41 include/openbabel/rotor.h
    2218 2020-05-08 17:41 include/openbabel/molchrg.h
    2482 2020-05-08 17:41 include/openbabel/matrix.h
    2021 2020-05-08 17:41 include/openbabel/kekulize.h
    2455 2020-05-08 17:41 include/openbabel/tokenst.h
   12292 2020-05-08 17:41 include/openbabel/grid.h
      dir 2020-05-08 17:41 include/openbabel/math/
      dir 2020-05-08 17:41 include/openbabel/depict/
   20758 2020-05-08 17:41 include/openbabel/atom.h
    5088 2020-05-08 17:41 include/openbabel/griddata.h
    2257 2020-05-08 17:41 include/openbabel/canon.h
    3460 2020-05-08 17:41 include/openbabel/reaction.h
   70033 2020-05-08 17:41 include/openbabel/forcefield.h
    1017 2020-05-08 17:41 include/openbabel/shared_ptr.h
    9626 2020-05-08 17:41 include/openbabel/inchiformat.h
    8031 2020-05-08 17:41 include/openbabel/xml.h
    2593 2020-05-08 17:41 include/openbabel/obfunctions.h
    1336 2020-05-08 17:41 include/openbabel/json.h
    4158 2020-05-08 17:41 include/openbabel/phmodel.h
   31087 2020-05-08 17:41 include/openbabel/spectrophore.h
    2997 2020-05-08 17:41 include/openbabel/pointgroup.h
    5918 2020-05-08 17:41 include/openbabel/distgeom.h
   14099 2020-05-08 17:41 include/openbabel/residue.h
    8775 2020-05-08 17:41 include/openbabel/builder.h
    2325 2020-05-08 17:41 include/openbabel/patty.h
    5769 2020-05-08 17:41 include/openbabel/rotamer.h
    9721 2020-05-08 17:41 include/openbabel/obutil.h
    9029 2020-05-08 17:41 include/openbabel/bitvec.h
    6553 2020-05-08 17:41 include/openbabel/lineend.h
    2949 2020-05-08 17:41 include/openbabel/data_utilities.h
    6337 2020-05-08 17:41 include/openbabel/format.h
    4815 2020-05-08 17:41 include/openbabel/kinetics.h
    5978 2020-05-08 17:41 include/openbabel/mcdlutil.h
    1795 2020-05-08 17:41 include/openbabel/bondtyper.h
    7765 2020-05-08 17:41 include/openbabel/fingerprint.h
   12086 2020-05-08 17:41 include/openbabel/parsmart.h
    3206 2020-05-08 17:41 include/openbabel/typer.h
   11923 2020-05-08 17:41 include/openbabel/bond.h
   13356 2020-05-08 17:41 include/openbabel/base.h
    3301 2020-05-08 17:41 include/openbabel/depict/depict.h
    2233 2020-05-08 17:41 include/openbabel/depict/cairopainter.h
    2098 2020-05-08 17:41 include/openbabel/depict/commandpainter.h
    2868 2020-05-08 17:41 include/openbabel/depict/svgpainter.h
    6472 2020-05-08 17:41 include/openbabel/depict/painter.h
    2440 2020-05-08 17:41 include/openbabel/depict/asciipainter.h
    7859 2020-05-08 17:41 include/openbabel/math/align.h
    9153 2020-05-08 17:41 include/openbabel/math/matrix3x3.h
    3314 2020-05-08 17:41 include/openbabel/math/spacegroup.h
    2142 2020-05-08 17:41 include/openbabel/math/erf.h
    2397 2020-05-08 17:41 include/openbabel/math/transform3d.h
   11605 2020-05-08 17:41 include/openbabel/math/vector3.h
   11262 2020-05-08 17:41 include/openbabel/stereo/tetrahedral.h
   48500 2020-05-08 17:41 include/openbabel/stereo/stereo.h
    8115 2020-05-08 17:41 include/openbabel/stereo/tetranonplanar.h
   12931 2020-05-08 17:41 include/openbabel/stereo/cistrans.h
    4956 2020-05-08 17:41 include/openbabel/stereo/tetraplanar.h
    8689 2020-05-08 17:41 include/openbabel/stereo/bindings.h
   10613 2020-05-08 17:41 include/openbabel/stereo/squareplanar.h
    2453 2020-05-08 17:41 include/openbabel/tree/tree_util.hh
   82284 2020-05-08 17:41 include/openbabel/tree/tree.hh
    5099 2020-05-08 17:41 include/libxml/chvalid.h
   16280 2020-05-08 17:41 include/libxml/parserInternals.h
    3411 2020-05-08 17:41 include/libxml/xpointer.h
    5181 2020-05-08 17:41 include/libxml/debugXML.h
    2274 2020-05-08 17:41 include/libxml/uri.h
   37198 2020-05-08 17:41 include/libxml/parser.h
    7931 2020-05-08 17:41 include/libxml/encoding.h
   32200 2020-05-08 17:41 include/libxml/tree.h
    1705 2020-05-08 17:41 include/libxml/threads.h
    5942 2020-05-08 17:41 include/libxml/xmlversion.h
   13458 2020-05-08 17:41 include/libxml/globals.h
    4958 2020-05-08 17:41 include/libxml/catalog.h
    1887 2020-05-08 17:41 include/libxml/pattern.h
   11833 2020-05-08 17:41 include/libxml/xmlreader.h
    3558 2020-05-08 17:41 include/libxml/HTMLtree.h
    4878 2020-05-08 17:41 include/libxml/SAX2.h
    3292 2020-05-08 17:41 include/libxml/xmlexports.h
    5051 2020-05-08 17:41 include/libxml/xlink.h
    4412 2020-05-08 17:41 include/libxml/SAX.h
    4352 2020-05-08 17:41 include/libxml/entities.h
    2545 2020-05-08 17:41 include/libxml/xmlregexp.h
    3422 2020-05-08 17:41 include/libxml/list.h
    2675 2020-05-08 17:41 include/libxml/xinclude.h
   35166 2020-05-08 17:41 include/libxml/xmlerror.h
   22398 2020-05-08 17:41 include/libxml/schemasInternals.h
    1582 2020-05-08 17:41 include/libxml/dict.h
   10253 2020-05-08 17:41 include/libxml/xmlIO.h
    9034 2020-05-08 17:41 include/libxml/HTMLparser.h
    3747 2020-05-08 17:41 include/libxml/xmlautomata.h
    1910 2020-05-08 17:41 include/libxml/xmlsave.h
    5467 2020-05-08 17:41 include/libxml/xmlstring.h
   15387 2020-05-08 17:41 include/libxml/xpath.h
   13747 2020-05-08 17:41 include/libxml/valid.h
    4275 2020-05-08 17:41 include/libxml/xmlschemastypes.h
    2583 2020-05-08 17:41 include/libxml/c14n.h
    3277 2020-05-08 17:41 include/libxml/DOCBparser.h
    1171 2020-05-08 17:41 include/libxml/xmlmodule.h
    5264 2020-05-08 17:41 include/libxml/relaxng.h
    2018 2020-05-08 17:41 include/libxml/nanohttp.h
    4507 2020-05-08 17:41 include/libxml/xmlwin32version.h
   10002 2020-05-08 17:41 include/libxml/xmlunicode.h
   20326 2020-05-08 17:41 include/libxml/xmlwriter.h
    5858 2020-05-08 17:41 include/libxml/xmlmemory.h
   19448 2020-05-08 17:41 include/libxml/xpathInternals.h
    3347 2020-05-08 17:41 include/libxml/nanoftp.h
    6567 2020-05-08 17:41 include/libxml/hash.h
    4796 2020-05-08 17:41 include/libxml/xmlschemas.h
    2962 2020-05-08 17:41 include/inchi/ichicano.h
    5125 2020-05-08 17:41 include/inchi/inchi_dll_a.h
   15736 2020-05-08 17:41 include/inchi/inpdef.h
   13287 2020-05-08 17:41 include/inchi/extr_ct.h
    2652 2020-05-08 17:41 include/inchi/ichister.h
   18666 2020-05-08 17:41 include/inchi/ichitaut.h
    5103 2020-05-08 17:41 include/inchi/ichinorm.h
   55310 2020-05-08 17:41 include/inchi/inchi_api.h
   16514 2020-05-08 17:41 include/inchi/ichicant.h
    5340 2020-05-08 17:41 include/inchi/ichierr.h
    2904 2020-05-08 17:41 include/inchi/ichicomp.h
   22938 2020-05-08 17:41 include/inchi/ichi_bns.h
    1869 2020-05-08 17:41 include/inchi/inchi_dll_main.h
    3415 2020-05-08 17:41 include/inchi/sha2.h
    7603 2020-05-08 17:41 include/inchi/inchicmp.h
   46254 2020-05-08 17:41 include/inchi/mode.h
   53373 2020-05-08 17:41 include/inchi/lreadmol.h
    5079 2020-05-08 17:41 include/inchi/ikey_base26.h
    4531 2020-05-08 17:41 include/inchi/util.h
   51058 2020-05-08 17:41 include/inchi/ichirvrs.h
  140687 2020-05-08 17:41 include/inchi/aux2atom.h
   16139 2020-05-08 17:41 include/inchi/ichicomn.h
  108599 2020-05-08 17:41 include/inchi/ichiparm.h
    3124 2020-05-08 17:41 include/inchi/ichi_io.h
    2322 2020-05-08 17:41 include/inchi/ichiring.h
   14670 2020-05-08 17:41 include/inchi/ichi.h
   10612 2020-05-08 17:41 include/inchi/ichimain.h
   19851 2020-05-08 17:41 include/inchi/strutil.h
    3076 2020-05-08 17:41 include/inchi/ichitime.h
    5626 2020-05-08 17:41 include/inchi/incomdef.h
    6345 2020-05-08 17:41 include/inchi/ichidrp.h
    1918 2020-05-08 17:41 include/inchi/ichisize.h
   13765 2020-05-08 17:41 include/inchi/ichimake.h
     924 2020-05-08 17:41 cmake/cmake_uninstall.cmake.in
      dir 2020-05-08 17:41 cmake/modules/
     823 2020-05-08 17:41 cmake/modules/FindInchi.cmake
    2995 2020-05-08 17:41 cmake/modules/FindEigen3.cmake
    1462 2020-05-08 17:41 cmake/modules/Findcoordgen.cmake
    2866 2020-05-08 17:41 cmake/modules/FindEigen2.cmake
    3034 2020-05-08 17:41 cmake/modules/OptimizeNative.cmake
     974 2020-05-08 17:41 cmake/modules/Findmaeparser.cmake
    1753 2020-05-08 17:41 cmake/modules/FindRapidJSON.cmake
    2984 2020-05-08 17:41 cmake/modules/UsePythonTest.cmake
    1438 2020-05-08 17:41 cmake/modules/FindCairo.cmake
    6906 2020-05-08 17:41 test/testpdbformat.py
      dir 2020-05-08 17:41 test/inchi/
     336 2020-05-08 17:41 test/aromatic.pl
    4386 2020-05-08 17:41 test/strip.cpp
     378 2020-05-08 17:41 test/inchi.pl
     921 2020-05-08 17:41 test/test_pybel.py
      dir 2020-05-08 17:41 test/cmltest/
    5254 2020-05-08 17:41 test/ffgaff.cpp
     549 2020-05-08 17:41 test/test_depiction.sh
    5962 2020-05-08 17:41 test/charge_gasteiger.cpp
    7979 2020-05-08 17:41 test/isomorphismtest.cpp
    2872 2020-05-08 17:41 test/tetranonplanartest.cpp
      dir 2020-05-08 17:41 test/cdjson/
    1741 2020-05-08 17:41 test/bond.cpp
    4241 2020-05-08 17:41 test/buildertest.cpp
     447 2020-05-08 17:41 test/cml.sh
   14093 2020-05-08 17:41 test/smilestest.cpp
   10865 2020-05-08 17:41 test/CMakeLists.txt
    1107 2020-05-08 17:41 test/implicitHtest.cpp
   11554 2020-05-08 17:41 test/tautomertest.cpp
    7114 2020-05-08 17:41 test/ringtest.cpp
    1999 2020-05-08 17:41 test/format.cpp
    4956 2020-05-08 17:41 test/uniqueidtest.cpp
      dir 2020-05-08 17:41 test/pdb_ligands_sdf/
    3796 2020-05-08 17:41 test/inchiwrite.cpp
    6693 2020-05-08 17:41 test/squareplanartest.cpp
    6502 2020-05-08 17:41 test/lssrtest.cpp
    3338 2020-05-08 17:41 test/tetraplanartest.cpp
    4304 2020-05-08 17:41 test/invalidsmarts.cpp
   19026 2020-05-08 17:41 test/regressionstest.cpp
    4387 2020-05-08 17:41 test/obbench.h
   11970 2020-05-08 17:41 test/math.cpp
   18161 2020-05-08 17:41 test/testbabel.py
    2461 2020-05-08 17:41 test/atom.cpp
   10318 2020-05-08 17:41 test/graphsymtest.cpp
     392 2020-05-08 17:41 test/inchi2.pl
    2090 2020-05-08 17:41 test/obtest.h
    3039 2020-05-08 17:41 test/carspacegrouptest.cpp
    1411 2020-05-08 17:41 test/conversiontest.cpp
    5614 2020-05-08 17:41 test/rotortest.cpp
    4731 2020-05-08 17:41 test/aromatest.cpp
    2383 2020-05-08 17:41 test/smileytest.cpp
    5887 2020-05-08 17:41 test/testkekule.py
    7258 2020-05-08 17:41 test/roundtrip.cpp
    1508 2020-05-08 17:41 test/canonfragmenttest.cpp
    1960 2020-05-08 17:41 test/mmff94validate.cpp
      dir 2020-05-08 17:41 test/pcjson/
   15053 2020-05-08 17:41 test/testsym.py
    7895 2020-05-08 17:41 test/residue.cpp
    3202 2020-05-08 17:41 test/testdistgeom.py
   10277 2020-05-08 17:41 test/testpcjsonformat.py
    3226 2020-05-08 17:41 test/zipstream.cpp
     781 2020-05-08 17:41 test/README
    3434 2020-05-08 17:41 test/pdbreadfile.cpp
   24799 2020-05-08 17:41 test/spectrophoretest.cpp
    4195 2020-05-08 17:41 test/testsmartssym.py
    3201 2020-05-08 17:41 test/smilesmatch.cpp
    2366 2020-05-08 17:41 test/cansmiles_shuffle.sh
    6020 2020-05-08 17:41 test/charge_mmff94.cpp
   45388 2020-05-08 17:41 test/testbindings.py
   10541 2020-05-08 17:41 test/cistranstest.cpp
    6941 2020-05-08 17:41 test/formula.cpp
   11462 2020-05-08 17:41 test/cifspacegrouptest.cpp
    4407 2020-05-08 17:41 test/addhtest.cpp
    3308 2020-05-08 17:41 test/logp_psa.cpp
    6140 2020-05-08 17:41 test/mol.cpp
   17023 2020-05-08 17:41 test/shuffletest.cpp
    3537 2020-05-08 17:41 test/aliastest.cpp
    6519 2020-05-08 17:41 test/ffmmff94.cpp
    4610 2020-05-08 17:41 test/iterators.cpp
      dir 2020-05-08 17:41 test/rinchi/
    3611 2020-05-08 17:41 test/testRInChI.py
   15897 2020-05-08 17:41 test/stereoperceptiontest.cpp
     312 2020-05-08 17:41 test/obtest.cpp
     616 2020-05-08 17:41 test/generate.sh
     953 2020-05-08 17:41 test/obmolbenchmark.cpp
    4715 2020-05-08 17:41 test/invalidsmiles.cpp
    2333 2020-05-08 17:41 test/multicmltest.cpp
    4018 2020-05-08 17:41 test/testcdjsonformat.py
    2836 2020-05-08 17:41 test/canonconsistenttest.cpp
    1628 2020-05-08 17:41 test/datatest.cpp
      dir 2020-05-08 17:41 test/files/
    1914 2020-05-08 17:41 test/testfastsearch.py
    3269 2020-05-08 17:41 test/cansmi.cpp
     488 2020-05-08 17:41 test/test-set.sh
    7351 2020-05-08 17:41 test/testroundtrip.py
    7172 2020-05-08 17:41 test/periodictest.cpp
    1677 2020-05-08 17:41 test/testunique.py
    1351 2020-05-08 17:41 test/canonstabletest.cpp
    3322 2020-05-08 17:41 test/automorphismtest.cpp
    7089 2020-05-08 17:41 test/tetrahedraltest.cpp
   10873 2020-05-08 17:41 test/phmodel.cpp
    4774 2020-05-08 17:41 test/gziptest.cpp
    7624 2020-05-08 17:41 test/smartstest.cpp
  125685 2020-05-08 17:41 test/testobconv_writers.py
    3189 2020-05-08 17:41 test/conversion.cpp
    5277 2020-05-08 17:41 test/ffuff.cpp
   11754 2020-05-08 17:41 test/aligntest.cpp
    2280 2020-05-08 17:41 test/smartsparse.cpp
    3895 2020-05-08 17:41 test/formalcharge.cpp
    2926 2020-05-08 17:41 test/cmlreadfile.cpp
    1021 2020-05-08 17:41 test/testexample.py
    5325 2020-05-08 17:41 test/ffghemical.cpp
    1661 2020-05-08 17:41 test/internalcoord.cpp
   16764 2020-05-08 17:41 test/stereotest.cpp
   10336 2020-05-08 17:41 test/unitcell.cpp
    2968 2020-05-08 17:41 test/maereadertest.cpp
    3746 2020-05-08 17:41 test/files/culgi_10_from_mol.cof
    1136 2020-05-08 17:41 test/files/test1.car
     828 2020-05-08 17:41 test/files/dipole-gasteiger.txt
    2852 2020-05-08 17:41 test/files/culgi_00.cof
    7304 2020-05-08 17:41 test/files/formularesults.txt
    1716 2020-05-08 17:41 test/files/culgi_05_from_mol.cof
    3270 2020-05-08 17:41 test/files/culgi_02_from_mol.cof
    1484 2020-05-08 17:41 test/files/culgi_01.cof
    1465 2020-05-08 17:41 test/files/maereader.maegz
    5177 2020-05-08 17:41 test/files/progesterone.sdf
    5475 2020-05-08 17:41 test/files/culgi_03.mol2
     128 2020-05-08 17:41 test/files/more-mmff94sresults.txt
   10730 2020-05-08 17:41 test/files/formalchargeresults.txt
   25418 2020-05-08 17:41 test/files/ringresults.txt
    1134 2020-05-08 17:41 test/files/test2.car
    4274 2020-05-08 17:41 test/files/mol24.mol2
    3923 2020-05-08 17:41 test/files/culgi_03.cof
    3946 2020-05-08 17:41 test/files/mol24_from_mol2.cof
   46670 2020-05-08 17:41 test/files/gaff.sdf
    2597 2020-05-08 17:41 test/files/culgi_02.cof
     288 2020-05-08 17:41 test/files/mmff94e4results.txt
    1135 2020-05-08 17:41 test/files/test3.car
    9728 2020-05-08 17:41 test/files/charge-mmff94.txt
    4984 2020-05-08 17:41 test/files/culgi_03_from_mol.cof
    2758 2020-05-08 17:41 test/files/culgi_04_from_mol.cof
    3059 2020-05-08 17:41 test/files/culgi_06.cof
 2660395 2020-05-08 17:41 test/files/CFGB09.CONFIG
    1621 2020-05-08 17:41 test/files/many.sdf.gz
      dir 2020-05-08 17:41 test/files/stereo/
    4377 2020-05-08 17:41 test/files/culgi_11_from_mol.cof
     128 2020-05-08 17:41 test/files/more-mmff94results.txt
    2135 2020-05-08 17:41 test/files/culgi_09_from_mol2.cof
    2130 2020-05-08 17:41 test/files/culgi_07.cof
     828 2020-05-08 17:41 test/files/dipole-mmff94.txt
     659 2020-05-08 17:41 test/files/MeCN.cdx
    3460 2020-05-08 17:41 test/files/culgi_02.mol2
    1374 2020-05-08 17:41 test/files/culgi_05.cof
    3632 2020-05-08 17:41 test/files/culgi_11.cof
     154 2020-05-08 17:41 test/files/c5.smi.gz
     150 2020-05-08 17:41 test/files/unitcell_results.txt
   45491 2020-05-08 17:41 test/files/forcefield.sdf
    2969 2020-05-08 17:41 test/files/culgi_10.cof
    2195 2020-05-08 17:41 test/files/culgi_04.cof
    1585 2020-05-08 17:41 test/files/isomorphism1.cml
     847 2020-05-08 17:41 test/files/hao_xu_6.mol
    2901 2020-05-08 17:41 test/files/gzip.in
   14145 2020-05-08 17:41 test/files/filterset.sdf
     656 2020-05-08 17:41 test/files/alias.mol
     907 2020-05-08 17:41 test/files/hao_xu_7.mol
    2138 2020-05-08 17:41 test/files/culgi_09.mol2
    4984 2020-05-08 17:41 test/files/culgi_03_from_mol2.cof
    1353 2020-05-08 17:41 test/files/hao_xu_5.mol
    1924 2020-05-08 17:41 test/files/culgi_09.mol
    1965 2020-05-08 17:41 test/files/00T_nonstandard_het.pdb
    3746 2020-05-08 17:41 test/files/culgi_10_from_mol2.cof
    2500 2020-05-08 17:41 test/files/test08.cif
    2229 2020-05-08 17:41 test/files/00T_ideal.pdb
     854 2020-05-08 17:41 test/files/invalid-smiles.txt
    4446 2020-05-08 17:41 test/files/test09.pdb
     790 2020-05-08 17:41 test/files/smartstest.txt
    2135 2020-05-08 17:41 test/files/culgi_09_from_mol.cof
    2685 2020-05-08 17:41 test/files/culgi_07_from_mol2.cof
    4378 2020-05-08 17:41 test/files/culgi_08.mol
    1680 2020-05-08 17:41 test/files/culgi_05.mol2
    1353 2020-05-08 17:41 test/files/hao_xu_4.mol
  394969 2020-05-08 17:41 test/files/smartsresults.txt
   13507 2020-05-08 17:41 test/files/1ubq.pdb.gz
    2859 2020-05-08 17:41 test/files/culgi_04.mol2
    3580 2020-05-08 17:41 test/files/monoclinic.car
    3371 2020-05-08 17:41 test/files/culgi_00_from_mol2.cof
    2758 2020-05-08 17:41 test/files/culgi_04_from_mol2.cof
   70725 2020-05-08 17:41 test/files/implicitH.sdf
     288 2020-05-08 17:41 test/files/uffresults.txt
     136 2020-05-08 17:41 test/files/unitcell.txt
   16035 2020-05-08 17:41 test/files/attype.00.smi
    1043 2020-05-08 17:41 test/files/hao_xu_1.mol
   78335 2020-05-08 17:41 test/files/random2
    4378 2020-05-08 17:41 test/files/culgi_08_from_mol.cof
    4806 2020-05-08 17:41 test/files/culgi_08.mol2
     692 2020-05-08 17:41 test/files/hao_xu_3.mol
    3051 2020-05-08 17:41 test/files/c4.mol2.gz
  100862 2020-05-08 17:41 test/files/random3
   34148 2020-05-08 17:41 test/files/nci.smi
  108416 2020-05-08 17:41 test/files/cantest.sdf
    1217 2020-05-08 17:41 test/files/hao_xu_2.mol
  779286 2020-05-08 17:41 test/files/5sun_protein.mol2
    4970 2020-05-08 17:41 test/files/culgi_03.mol
     288 2020-05-08 17:41 test/files/ghemicalresults.txt
    1716 2020-05-08 17:41 test/files/culgi_05_from_mol2.cof
    2743 2020-05-08 17:41 test/files/test03.cif
    2612 2020-05-08 17:41 test/files/test02.cif
     671 2020-05-08 17:41 test/files/alanine.cdxml
   51400 2020-05-08 17:41 test/files/kevlar.sdf
    4282 2020-05-08 17:41 test/files/regressiontest_numrotors.mol
    1727 2020-05-08 17:41 test/files/culgi_01_from_mol2.cof
    3134 2020-05-08 17:41 test/files/culgi_02.mol
    3233 2020-05-08 17:41 test/files/testsym_2Dtests_threeligands.sdf
    3270 2020-05-08 17:41 test/files/culgi_00.mol
    2839 2020-05-08 17:41 test/files/culgi_07.mol2
     750 2020-05-08 17:41 test/files/alanine.mol
    3447 2020-05-08 17:41 test/files/3o8g_uff.sdf
    4806 2020-05-08 17:41 test/files/culgi_11.mol2
   10744 2020-05-08 17:41 test/files/test01.cif
     304 2020-05-08 17:41 test/files/gaffresults.txt
    1552 2020-05-08 17:41 test/files/culgi_01.mol
    9728 2020-05-08 17:41 test/files/charge-gasteiger.txt
     847 2020-05-08 17:41 test/files/hao_xu_9.mol
    1530 2020-05-08 17:41 test/files/culgi_05.mol
    4378 2020-05-08 17:41 test/files/culgi_11.mol
    1402 2020-05-08 17:41 test/files/aromatics.smi
   16174 2020-05-08 17:41 test/files/more-mmff94.sdf
  271635 2020-05-08 17:41 test/files/cansmi-roundtrip.smi
    1299 2020-05-08 17:41 test/files/ethanol.cdx
    4754 2020-05-08 17:41 test/files/test05.cif
    4075 2020-05-08 17:41 test/files/culgi_10.mol2
    2306 2020-05-08 17:41 test/files/test04.cif
     288 2020-05-08 17:41 test/files/mmff94sresults.txt
    3712 2020-05-08 17:41 test/files/culgi_10.mol
    2576 2020-05-08 17:41 test/files/culgi_04.mol
     907 2020-05-08 17:41 test/files/hao_xu_8.mol
    4020 2020-05-08 17:41 test/files/tencmpds.sdf.gz
    4377 2020-05-08 17:41 test/files/culgi_11_from_mol2.cof
    1933 2020-05-08 17:41 test/files/test06.cif
    2769 2020-05-08 17:41 test/files/test07.cif
   11286 2020-05-08 17:41 test/files/c3.cml
    3084 2020-05-08 17:41 test/files/octane.cml
    3021 2020-05-08 17:41 test/files/testsym_2Dtests.sdf
    2388 2020-05-08 17:41 test/files/five_obabel.sdf.gz
     288 2020-05-08 17:41 test/files/mmff94results.txt
    2586 2020-05-08 17:41 test/files/culgi_07.mol
    3270 2020-05-08 17:41 test/files/culgi_02_from_mol2.cof
    1704 2020-05-08 17:41 test/files/culgi_01.mol2
 1625346 2020-05-08 17:41 test/files/3G61.pdb
    1712 2020-05-08 17:41 test/files/culgi_09.cof
    4378 2020-05-08 17:41 test/files/culgi_08_from_mol2.cof
      dir 2020-05-08 17:41 test/files/rings/
    1727 2020-05-08 17:41 test/files/culgi_01_from_mol.cof
    3447 2020-05-08 17:41 test/files/culgi_08.cof
    7291 2020-05-08 17:41 test/files/maereader.mae
    3893 2020-05-08 17:41 test/files/mol24.mol
     344 2020-05-08 17:41 test/files/invalid-smarts.txt
    1263 2020-05-08 17:41 test/files/test3d.xyz
   14281 2020-05-08 17:41 test/files/alias.png
  105004 2020-05-08 17:41 test/files/random
    2565 2020-05-08 17:41 test/files/test02.nohall.cif
    2645 2020-05-08 17:41 test/files/molrxnmix.cdx
    3946 2020-05-08 17:41 test/files/mol24_from_mol.cof
    2182 2020-05-08 17:41 test/files/FormulaTest.smi
    1099 2020-05-08 17:41 test/files/stripresults.txt
     128 2020-05-08 17:41 test/files/more-mmff94e4results.txt
    1965 2020-05-08 17:41 test/files/00T_nonstandard.pdb
    2229 2020-05-08 17:41 test/files/00T_ideal_het.pdb
    1678 2020-05-08 17:41 test/files/c3.cml.gz
  447893 2020-05-08 17:41 test/files/addh.in
   19882 2020-05-08 17:41 test/files/ziptest.sdf.gz
  121755 2020-05-08 17:41 test/files/canonstable.can
    3371 2020-05-08 17:41 test/files/culgi_00_from_mol.cof
    2685 2020-05-08 17:41 test/files/culgi_07_from_mol.cof
  135494 2020-05-08 17:41 test/files/CFGT27.CONFIG
     626 2020-05-08 17:41 test/files/test2d.xyz
    4148 2020-05-08 17:41 test/files/1519159.cif
   10315 2020-05-08 17:41 test/files/validsmarts.txt
    5593 2020-05-08 17:41 test/files/testsym_2Dtests_more.sdf
    5602 2020-05-08 17:41 test/files/3d.head.2.cml
    3610 2020-05-08 17:41 test/files/culgi_00.mol2
    6923 2020-05-08 17:41 test/files/102Uridine.smi
  183627 2020-05-08 17:41 test/files/1DRF.pdb
  283238 2020-05-08 17:41 test/files/aromatics.png
    1286 2020-05-08 17:41 test/files/rings/cubane2.mdl
    6252 2020-05-08 17:41 test/files/rings/fullerene60.mdl
    1470 2020-05-08 17:41 test/files/rings/cubane.mdl
     756 2020-05-08 17:41 test/files/rings/octahedron.mdl
     830 2020-05-08 17:41 test/files/rings/bridged1.mdl
     966 2020-05-08 17:41 test/files/rings/tetrahedron.mdl
    2132 2020-05-08 17:41 test/files/rings/fullerene20.mdl
     415 2020-05-08 17:41 test/files/stereo/tetrahedral2D_1.mol
     900 2020-05-08 17:41 test/files/stereo/razinger_fig7_19_spec5.mol
    4138 2020-05-08 17:41 test/files/stereo/canon17a.mol
     900 2020-05-08 17:41 test/files/stereo/razinger_fig7_19_spec4.mol
    1176 2020-05-08 17:41 test/files/stereo/inositol_scyllo.mol
      35 2020-05-08 17:41 test/files/stereo/cyclobutane_D1.smi
     344 2020-05-08 17:41 test/files/stereo/tetrahedral2D_2.mol
    1062 2020-05-08 17:41 test/files/stereo/razinger_fig7_64.mol
     839 2020-05-08 17:41 test/files/stereo/razinger_fig7_58.mol
    4138 2020-05-08 17:41 test/files/stereo/canon17b.mol
    1176 2020-05-08 17:41 test/files/stereo/inositol_myo.mol
     975 2020-05-08 17:41 test/files/stereo/razinger_fig7_59.mol
     344 2020-05-08 17:41 test/files/stereo/tetrahedral2D_3.mol
     808 2020-05-08 17:41 test/files/stereo/cyclohexanediol_D1.mol
     344 2020-05-08 17:41 test/files/stereo/tetrahedral2D_7.mol
     839 2020-05-08 17:41 test/files/stereo/razinger_fig7_49.mol
    2033 2020-05-08 17:41 test/files/stereo/razinger_fig7_61.mol
     900 2020-05-08 17:41 test/files/stereo/razinger_fig7_19_spec3.mol
     900 2020-05-08 17:41 test/files/stereo/razinger_fig7_19_spec2.mol
     975 2020-05-08 17:41 test/files/stereo/razinger_fig7_60.mol
     771 2020-05-08 17:41 test/files/stereo/razinger_fig7_48.mol
     344 2020-05-08 17:41 test/files/stereo/tetrahedral2D_6.mol
     415 2020-05-08 17:41 test/files/stereo/tetrahedral2D_4.mol
     808 2020-05-08 17:41 test/files/stereo/cyclohexanediol_D2.mol
    1625 2020-05-08 17:41 test/files/stereo/razinger_fig7_62.mol
     900 2020-05-08 17:41 test/files/stereo/razinger_fig7_19_spec1.mol
    2509 2020-05-08 17:41 test/files/stereo/razinger_fig7_63.mol
     415 2020-05-08 17:41 test/files/stereo/tetrahedral2D_5.mol
    1246 2020-05-08 17:41 test/files/stereo/razinger_fig7_5_spec.mol
     937 2020-05-08 17:41 test/files/stereo/razinger_fig7_8.mol
    1621 2020-05-08 17:41 test/files/stereo/canon20.mol
     970 2020-05-08 17:41 test/files/stereo/canon_cistrans1.mol
     937 2020-05-08 17:41 test/files/stereo/razinger_fig7_10.mol
    1005 2020-05-08 17:41 test/files/stereo/razinger_fig7_38.mol
     907 2020-05-08 17:41 test/files/stereo/razinger_fig1_h.mol
    1259 2020-05-08 17:41 test/files/stereo/perception14.mol
    1191 2020-05-08 17:41 test/files/stereo/perception15.mol
     684 2020-05-08 17:41 test/files/stereo/razinger_fig1_i.mol
     695 2020-05-08 17:41 test/files/stereo/perception1.mol
    1073 2020-05-08 17:41 test/files/stereo/razinger_fig7_39.mol
    1209 2020-05-08 17:41 test/files/stereo/razinger_fig7_11.mol
     356 2020-05-08 17:41 test/files/stereo/cistrans2D_1.mol
    1176 2020-05-08 17:41 test/files/stereo/razinger_fig7_26_spec1.mol
    2725 2020-05-08 17:41 test/files/stereo/canon21.mol
     937 2020-05-08 17:41 test/files/stereo/razinger_fig7_9.mol
    1176 2020-05-08 17:41 test/files/stereo/inositol_epi.mol
     631 2020-05-08 17:41 test/files/stereo/canon23.mol
     970 2020-05-08 17:41 test/files/stereo/canon_cistrans2.mol
     938 2020-05-08 17:41 test/files/stereo/error2.smi
    1005 2020-05-08 17:41 test/files/stereo/razinger_fig7_13.mol
    1204 2020-05-08 17:41 test/files/stereo/canon8.mol
     627 2020-05-08 17:41 test/files/stereo/perception3.mol
     733 2020-05-08 17:41 test/files/stereo/razinger_fig1_k.mol
     968 2020-05-08 17:41 test/files/stereo/perception17.mol
    1123 2020-05-08 17:41 test/files/stereo/perception16.mol
    1141 2020-05-08 17:41 test/files/stereo/razinger_fig1_j.mol
     763 2020-05-08 17:41 test/files/stereo/perception2.mol
    1209 2020-05-08 17:41 test/files/stereo/razinger_fig7_12.mol
    1572 2020-05-08 17:41 test/files/stereo/canon9.mol
     343 2020-05-08 17:41 test/files/stereo/cistrans2D_2.mol
     992 2020-05-08 17:41 test/files/stereo/canon_cistrans3.mol
     631 2020-05-08 17:41 test/files/stereo/canon22.mol
    1176 2020-05-08 17:41 test/files/stereo/canon_cistrans7.mol
     616 2020-05-08 17:41 test/files/stereo/razinger_fig7_16.mol
     992 2020-05-08 17:41 test/files/stereo/razinger_fig7_20_spec1.mol
     763 2020-05-08 17:41 test/files/stereo/perception6.mol
    1055 2020-05-08 17:41 test/files/stereo/perception12.mol
    1179 2020-05-08 17:41 test/files/stereo/razinger_fig1_n.mol
     733 2020-05-08 17:41 test/files/stereo/razinger_fig1_o.mol
    1123 2020-05-08 17:41 test/files/stereo/perception13.mol
     831 2020-05-08 17:41 test/files/stereo/perception7.mol
     616 2020-05-08 17:41 test/files/stereo/razinger_fig7_17.mol
    1176 2020-05-08 17:41 test/files/stereo/canon_cistrans6.mol
    1176 2020-05-08 17:41 test/files/stereo/inositol_chiroL.mol
    1941 2020-05-08 17:41 test/files/stereo/canon19.mol
     992 2020-05-08 17:41 test/files/stereo/canon_cistrans4.mol
     684 2020-05-08 17:41 test/files/stereo/razinger_fig7_29.mol
     616 2020-05-08 17:41 test/files/stereo/razinger_fig7_15.mol
     831 2020-05-08 17:41 test/files/stereo/perception5.mol
     987 2020-05-08 17:41 test/files/stereo/perception11.mol
    3760 2020-05-08 17:41 test/files/stereo/razinger_fig1_m.mol
    2887 2020-05-08 17:41 test/files/stereo/razinger_fig1_l.mol
     696 2020-05-08 17:41 test/files/stereo/perception10.mol
     899 2020-05-08 17:41 test/files/stereo/perception4.mol
     548 2020-05-08 17:41 test/files/stereo/razinger_fig7_14.mol
     684 2020-05-08 17:41 test/files/stereo/razinger_fig7_28.mol
    1176 2020-05-08 17:41 test/files/stereo/inositol_muco.mol
    1474 2020-05-08 17:41 test/files/stereo/canon_cistrans5.mol
    1573 2020-05-08 17:41 test/files/stereo/canon18.mol
    1404 2020-05-08 17:41 test/files/stereo/canon24.mol
     325 2020-05-08 17:41 test/files/stereo/tetrahedral3D_3.mol
     393 2020-05-08 17:41 test/files/stereo/razinger_fig7_1.mol
     815 2020-05-08 17:41 test/files/stereo/canon15.mol
    1750 2020-05-08 17:41 test/files/stereo/canon_cistrans8.mol
     721 2020-05-08 17:41 test/files/stereo/complex2D_1.mol
    1176 2020-05-08 17:41 test/files/stereo/inositol_allo.mol
    1160 2020-05-08 17:41 test/files/stereo/razinger_fig7_25.mol
     393 2020-05-08 17:41 test/files/stereo/razinger_fig7_31.mol
     684 2020-05-08 17:41 test/files/stereo/razinger_fig7_19.mol
     976 2020-05-08 17:41 test/files/stereo/canon2.mol
     763 2020-05-08 17:41 test/files/stereo/perception9.mol
     752 2020-05-08 17:41 test/files/stereo/razinger_fig1_a.mol
     968 2020-05-08 17:41 test/files/stereo/perception20.mol
     763 2020-05-08 17:41 test/files/stereo/perception8.mol
     616 2020-05-08 17:41 test/files/stereo/razinger_fig7_18.mol
     814 2020-05-08 17:41 test/files/stereo/canon3.mol
     325 2020-05-08 17:41 test/files/stereo/razinger_fig7_30.mol
     616 2020-05-08 17:41 test/files/stereo/razinger_fig7_24.mol
    1176 2020-05-08 17:41 test/files/stereo/inositol_cis.mol
     900 2020-05-08 17:41 test/files/stereo/canon_cistrans9.mol
     815 2020-05-08 17:41 test/files/stereo/canon14.mol
     393 2020-05-08 17:41 test/files/stereo/tetrahedral3D_2.mol
    1005 2020-05-08 17:41 test/files/stereo/razinger_fig7_2.mol
    2813 2020-05-08 17:41 test/files/stereo/canon16.mol
     841 2020-05-08 17:41 test/files/stereo/complex2D_2.mol
     461 2020-05-08 17:41 test/files/stereo/razinger_fig7_32.mol
     888 2020-05-08 17:41 test/files/stereo/razinger_fig7_26.mol
     976 2020-05-08 17:41 test/files/stereo/canon1.mol
    1092 2020-05-08 17:41 test/files/stereo/razinger_fig1_b.mol
     616 2020-05-08 17:41 test/files/stereo/razinger_fig1_c.mol
     752 2020-05-08 17:41 test/files/stereo/razinger_fig7_27.mol
     529 2020-05-08 17:41 test/files/stereo/razinger_fig7_33.mol
     628 2020-05-08 17:41 test/files/stereo/complex2D_3.mol
    4145 2020-05-08 17:41 test/files/stereo/canon17.mol
     869 2020-05-08 17:41 test/files/stereo/razinger_fig7_3.mol
     393 2020-05-08 17:41 test/files/stereo/tetrahedral3D_1.mol
    1176 2020-05-08 17:41 test/files/stereo/inositol_chiroD.mol
    1183 2020-05-08 17:41 test/files/stereo/canon13.mol
     937 2020-05-08 17:41 test/files/stereo/razinger_fig7_7.mol
     814 2020-05-08 17:41 test/files/stereo/complex2D_7.mol
     814 2020-05-08 17:41 test/files/stereo/canon4.mol
    1141 2020-05-08 17:41 test/files/stereo/razinger_fig7_37.mol
     616 2020-05-08 17:41 test/files/stereo/razinger_fig7_23.mol
     975 2020-05-08 17:41 test/files/stereo/razinger_fig1_g.mol
    2350 2020-05-08 17:41 test/files/stereo/canon_cistrans15.mol
    1277 2020-05-08 17:41 test/files/stereo/razinger_fig1_p.mol
    1043 2020-05-08 17:41 test/files/stereo/razinger_fig1_f.mol
    1290 2020-05-08 17:41 test/files/stereo/razinger_fig7_59_spec1.mol
     616 2020-05-08 17:41 test/files/stereo/razinger_fig7_22.mol
     597 2020-05-08 17:41 test/files/stereo/razinger_fig7_36.mol
    1338 2020-05-08 17:41 test/files/stereo/razinger_fig3.mol
    1296 2020-05-08 17:41 test/files/stereo/canon5.mol
    1220 2020-05-08 17:41 test/files/stereo/incorrect_canon2.mol
     672 2020-05-08 17:41 test/files/stereo/complex2D_6.mol
     937 2020-05-08 17:41 test/files/stereo/razinger_fig7_6.mol
     999 2020-05-08 17:41 test/files/stereo/canon12.mol
     325 2020-05-08 17:41 test/files/stereo/tetrahedral3D_4.mol
     631 2020-05-08 17:41 test/files/stereo/canon10.mol
     733 2020-05-08 17:41 test/files/stereo/razinger_fig7_4.mol
     906 2020-05-08 17:41 test/files/stereo/canon7.mol
     752 2020-05-08 17:41 test/files/stereo/razinger_fig7_20.mol
     597 2020-05-08 17:41 test/files/stereo/razinger_fig7_34.mol
     684 2020-05-08 17:41 test/files/stereo/razinger_fig1_d.mol
    1658 2020-05-08 17:41 test/files/stereo/canon_cistrans16.mol
    1036 2020-05-08 17:41 test/files/stereo/perception18.mol
     900 2020-05-08 17:41 test/files/stereo/perception19.mol
     888 2020-05-08 17:41 test/files/stereo/razinger_fig1_e.mol
     461 2020-05-08 17:41 test/files/stereo/razinger_fig7_35.mol
     820 2020-05-08 17:41 test/files/stereo/razinger_fig7_21.mol
     906 2020-05-08 17:41 test/files/stereo/canon6.mol
    1198 2020-05-08 17:41 test/files/stereo/incorrect_canon1.mol
     937 2020-05-08 17:41 test/files/stereo/razinger_fig7_5.mol
     815 2020-05-08 17:41 test/files/stereo/canon11.mol
     325 2020-05-08 17:41 test/files/stereo/cistrans3D_2.mol
     808 2020-05-08 17:41 test/files/stereo/cyclobutane_D2.mol
     934 2020-05-08 17:41 test/files/stereo/complex2D_4b.mol
     344 2020-05-08 17:41 test/files/stereo/tetrahedral2D_8.mol
     616 2020-05-08 17:41 test/files/stereo/razinger_fig7_46.mol
    1062 2020-05-08 17:41 test/files/stereo/razinger_fig7_52.mol
     703 2020-05-08 17:41 test/files/stereo/razinger_fig7_47.mol
     900 2020-05-08 17:41 test/files/stereo/cyclohexanetriol_D1.mol
     356 2020-05-08 17:41 test/files/stereo/tetrahedral2D_9.mol
     808 2020-05-08 17:41 test/files/stereo/cyclobutane_D3.mol
     393 2020-05-08 17:41 test/files/stereo/cistrans3D_3.mol
     461 2020-05-08 17:41 test/files/stereo/cistrans3D_1.mol
     808 2020-05-08 17:41 test/files/stereo/cyclobutane_D1.mol
     863 2020-05-08 17:41 test/files/stereo/complex2D_4a.mol
    1062 2020-05-08 17:41 test/files/stereo/razinger_fig7_51.mol
     684 2020-05-08 17:41 test/files/stereo/razinger_fig7_45.mol
     616 2020-05-08 17:41 test/files/stereo/razinger_fig7_44.mol
     703 2020-05-08 17:41 test/files/stereo/razinger_fig7_50.mol
     900 2020-05-08 17:41 test/files/stereo/cyclohexanetriol_D2.mol
     808 2020-05-08 17:41 test/files/stereo/cyclobutane_D4.mol
     461 2020-05-08 17:41 test/files/stereo/cistrans3D_4.mol
    1141 2020-05-08 17:41 test/files/stereo/razinger_fig7_40.mol
     480 2020-05-08 17:41 test/files/stereo/razinger_fig7_41.mol
    1176 2020-05-08 17:41 test/files/stereo/razinger_fig7_69.mol
     721 2020-05-08 17:41 test/files/stereo/complex2D_5a.mol
     393 2020-05-08 17:41 test/files/stereo/cistrans3D_5.mol
    1176 2020-05-08 17:41 test/files/stereo/inositol_neo.mol
     752 2020-05-08 17:41 test/files/stereo/razinger_fig7_43.mol
    1179 2020-05-08 17:41 test/files/stereo/razinger_fig7_57.mol
    1220 2020-05-08 17:41 test/files/stereo/adamantanediol.mol
    1160 2020-05-08 17:41 test/files/stereo/razinger_fig7_42.mol
     863 2020-05-08 17:41 test/files/stereo/complex2D_5b.mol
    2588 2020-05-08 17:41 test/rinchi/Tautomerization_01.rxn
     502 2020-05-08 17:41 test/rinchi/Styrene_-_Polystyrene_as_no-struct.txt
     472 2020-05-08 17:41 test/rinchi/1_reactant_-_X.txt
    1072 2020-05-08 17:41 test/rinchi/Inverted_stereochemistry.rxn
    1719 2020-05-08 17:41 test/rinchi/RingOpening01.rxn
     336 2020-05-08 17:41 test/rinchi/R-_-A.rxn
     481 2020-05-08 17:41 test/rinchi/no_structure_-_1_product.txt
     910 2020-05-08 17:41 test/rinchi/1_reactant_-_A.rxn
     413 2020-05-08 17:41 test/rinchi/star_star_-_nostruct.rxn
     484 2020-05-08 17:41 test/rinchi/X_-_1_product.txt
     252 2020-05-08 17:41 test/rinchi/nostruct_-_X.txt
     855 2020-05-08 17:41 test/rinchi/No_reactant_-_1_product_02.rxn
     763 2020-05-08 17:41 test/rinchi/No_reactant_-_1_product.rxn
     840 2020-05-08 17:41 test/rinchi/1_reactant_-_no_structure.rxn
     763 2020-05-08 17:41 test/rinchi/1_reactant_-_no_product.rxn
     910 2020-05-08 17:41 test/rinchi/1_reactant_-_R.rxn
     932 2020-05-08 17:41 test/rinchi/Styrene_-_Polystyrene_as_no-struct.rxn
    1047 2020-05-08 17:41 test/rinchi/Tautomerization_01.txt
     840 2020-05-08 17:41 test/rinchi/no_structure_-_1_product.rxn
     820 2020-05-08 17:41 test/rinchi/RingOpening01.txt
     252 2020-05-08 17:41 test/rinchi/R-_-A.txt
     584 2020-05-08 17:41 test/rinchi/Inverted_stereochemistry.txt
     910 2020-05-08 17:41 test/rinchi/1_reactant_-_X.rxn
     266 2020-05-08 17:41 test/rinchi/nostruct_-_X.rxn
     910 2020-05-08 17:41 test/rinchi/X_-_1_product.rxn
     472 2020-05-08 17:41 test/rinchi/1_reactant_-_A.txt
     280 2020-05-08 17:41 test/rinchi/star_star_-_nostruct.txt
     446 2020-05-08 17:41 test/rinchi/No_reactant_-_1_product.txt
     471 2020-05-08 17:41 test/rinchi/No_reactant_-_1_product_02.txt
     424 2020-05-08 17:41 test/rinchi/1_reactant_-_no_product.txt
     472 2020-05-08 17:41 test/rinchi/1_reactant_-_R.txt
     480 2020-05-08 17:41 test/rinchi/1_reactant_-_no_structure.txt
      25 2020-05-08 17:41 test/pcjson/empty.json
   12038 2020-05-08 17:41 test/pcjson/CID_2244_2D.json
   22909 2020-05-08 17:41 test/pcjson/CID_368849_2D.json
    9927 2020-05-08 17:41 test/pcjson/CID_10900_2D.json
    9082 2020-05-08 17:41 test/pcjson/CID_123164_2D.json
    3634 2020-05-08 17:41 test/pcjson/SID_348356775_2D.json
   11213 2020-05-08 17:41 test/pcjson/CID_6857552_2D.json
      38 2020-05-08 17:41 test/pcjson/invalid.json
   11884 2020-05-08 17:41 test/pcjson/CID_6137_2D.json
    9715 2020-05-08 17:41 test/pcjson/CID_638186_2D.json
       3 2020-05-08 17:41 test/pcjson/notobject.json
    9715 2020-05-08 17:41 test/pcjson/CID_643833_2D.json
    8658 2020-05-08 17:41 test/pcjson/CID_1038_2D.json
    5761 2020-05-08 17:41 test/pdb_ligands_sdf/5jzn_gui.sdf
    6004 2020-05-08 17:41 test/pdb_ligands_sdf/1npv_l27.sdf
    3006 2020-05-08 17:41 test/pdb_ligands_sdf/1umg_2fp.sdf
    3205 2020-05-08 17:41 test/pdb_ligands_sdf/5d1u_56p.sdf
    2057 2020-05-08 17:41 test/pdb_ligands_sdf/2wa3_a29.sdf
    6197 2020-05-08 17:41 test/pdb_ligands_sdf/1q6p_213.sdf
    1675 2020-05-08 17:41 test/pdb_ligands_sdf/3o9m_bez.sdf
    4008 2020-05-08 17:41 test/pdb_ligands_sdf/4kip_1r9.sdf
    1798 2020-05-08 17:41 test/pdb_ligands_sdf/3dt7_spv.sdf
    4158 2020-05-08 17:41 test/pdb_ligands_sdf/3emg_685.sdf
    4685 2020-05-08 17:41 test/pdb_ligands_sdf/1me6_ivs.sdf
    4316 2020-05-08 17:41 test/pdb_ligands_sdf/3nz9_d2k.sdf
    4082 2020-05-08 17:41 test/pdb_ligands_sdf/2bu6_tf2.sdf
    4470 2020-05-08 17:41 test/pdb_ligands_sdf/4p68_mtx.sdf
    3904 2020-05-08 17:41 test/pdb_ligands_sdf/3sp9_il2.sdf
    3780 2020-05-08 17:41 test/pdb_ligands_sdf/1bs4_2pe.sdf
    6034 2020-05-08 17:41 test/pdb_ligands_sdf/2q2n_h01.sdf
    1917 2020-05-08 17:41 test/pdb_ligands_sdf/3nsg_tam.sdf
    2669 2020-05-08 17:41 test/pdb_ligands_sdf/5v18_8uy.sdf
    4682 2020-05-08 17:41 test/pdb_ligands_sdf/2vwo_lzg.sdf
    3770 2020-05-08 17:41 test/pdb_ligands_sdf/5p9u_sah.sdf
    1746 2020-05-08 17:41 test/pdb_ligands_sdf/4n1p_wm1.sdf
    3425 2020-05-08 17:41 test/pdb_ligands_sdf/4b9d_ck7.sdf
     806 2020-05-08 17:41 test/pdb_ligands_sdf/4zhg_am.sdf
     367 2020-05-08 17:41 test/pdb_ligands_sdf/fetch.py
    4372 2020-05-08 17:41 test/pdb_ligands_sdf/4riw_anp.sdf
    3385 2020-05-08 17:41 test/pdb_ligands_sdf/5fj2_xeb.sdf
    4010 2020-05-08 17:41 test/pdb_ligands_sdf/1dpf_gdp.sdf
    5439 2020-05-08 17:41 test/pdb_ligands_sdf/3mg3_ech.sdf
    4368 2020-05-08 17:41 test/pdb_ligands_sdf/1cjk_tat.sdf
    2048 2020-05-08 17:41 test/pdb_ligands_sdf/2orq_msr.sdf
    2294 2020-05-08 17:41 test/pdb_ligands_sdf/4mmm_bp7.sdf
    2316 2020-05-08 17:41 test/pdb_ligands_sdf/4jkw_ipe.sdf
    4186 2020-05-08 17:41 test/pdb_ligands_sdf/3qtf_05s.sdf
    4659 2020-05-08 17:41 test/pdb_ligands_sdf/4rcd_3ll.sdf
    1700 2020-05-08 17:41 test/pdb_ligands_sdf/3t6i_z82.sdf
    3072 2020-05-08 17:41 test/pdb_ligands_sdf/2xtu_bng.sdf
    3450 2020-05-08 17:41 test/pdb_ligands_sdf/1cq1_pqq.sdf
    1984 2020-05-08 17:41 test/pdb_ligands_sdf/4zbc_glc.sdf
    3877 2020-05-08 17:41 test/pdb_ligands_sdf/5knu_6wa.sdf
    2969 2020-05-08 17:41 test/pdb_ligands_sdf/1cgk_nar.sdf
    3414 2020-05-08 17:41 test/pdb_ligands_sdf/5tc6_7a6.sdf
    2809 2020-05-08 17:41 test/pdb_ligands_sdf/1qye_cdy.sdf
    4545 2020-05-08 17:41 test/pdb_ligands_sdf/3l8v_l8v.sdf
    2193 2020-05-08 17:41 test/pdb_ligands_sdf/4g44_tzm.sdf
    2185 2020-05-08 17:41 test/pdb_ligands_sdf/3kcx_cql.sdf
    3795 2020-05-08 17:41 test/pdb_ligands_sdf/4d37_9hl.sdf
    3882 2020-05-08 17:41 test/pdb_ligands_sdf/1o0o_a2p.sdf
    3420 2020-05-08 17:41 test/pdb_ligands_sdf/2f3d_amp.sdf
    3465 2020-05-08 17:41 test/pdb_ligands_sdf/1c0u_bm5.sdf
    4568 2020-05-08 17:41 test/pdb_ligands_sdf/4uit_n1d.sdf
    2415 2020-05-08 17:41 test/pdb_ligands_sdf/5k8p_6r8.sdf
    3102 2020-05-08 17:41 test/pdb_ligands_sdf/1tve_178.sdf
    4492 2020-05-08 17:41 test/pdb_ligands_sdf/4zns_ofb.sdf
    2395 2020-05-08 17:41 test/pdb_ligands_sdf/1c85_oba.sdf
    5021 2020-05-08 17:41 test/pdb_ligands_sdf/5q1a_9n4.sdf
    2091 2020-05-08 17:41 test/pdb_ligands_sdf/3n36_gla.sdf
    4610 2020-05-08 17:41 test/pdb_ligands_sdf/5jiz_6fw.sdf
    1939 2020-05-08 17:41 test/pdb_ligands_sdf/1eoc_4nc.sdf
    6099 2020-05-08 17:41 test/pdb_ligands_sdf/5ebv_coa.sdf
    3878 2020-05-08 17:41 test/pdb_ligands_sdf/5ce3_adp.sdf
    2637 2020-05-08 17:41 test/pdb_ligands_sdf/1inf_st4.sdf
    2602 2020-05-08 17:41 test/pdb_ligands_sdf/1mk5_btn.sdf
    5750 2020-05-08 17:41 test/pdb_ligands_sdf/4jhq_b6f.sdf
    5909 2020-05-08 17:41 test/pdb_ligands_sdf/5lga_6vh.sdf
    3012 2020-05-08 17:41 test/pdb_ligands_sdf/3uxh_uxh.sdf
    3496 2020-05-08 17:41 test/pdb_ligands_sdf/3cy2_mb9.sdf
    2398 2020-05-08 17:41 test/pdb_ligands_sdf/4fxa_aag.sdf
    3410 2020-05-08 17:41 test/pdb_ligands_sdf/4rqk_r1s.sdf
    2118 2020-05-08 17:41 test/pdb_ligands_sdf/5is6_pg4.sdf
    3305 2020-05-08 17:41 test/pdb_ligands_sdf/3tvq_dqh.sdf
    3054 2020-05-08 17:41 test/pdb_ligands_sdf/1hx9_fhp.sdf
    2447 2020-05-08 17:41 test/pdb_ligands_sdf/5u5k_7vy.sdf
    7687 2020-05-08 17:41 test/pdb_ligands_sdf/3u18_y0x.sdf
    6342 2020-05-08 17:41 test/pdb_ligands_sdf/3hxc_bd6.sdf
    4658 2020-05-08 17:41 test/pdb_ligands_sdf/3dr1_c5d.sdf
    3053 2020-05-08 17:41 test/pdb_ligands_sdf/3sjx_qrg.sdf
    7079 2020-05-08 17:41 test/pdb_ligands_sdf/1bv7_xv6.sdf
    4500 2020-05-08 17:41 test/pdb_ligands_sdf/3fkl_fkl.sdf
    3236 2020-05-08 17:41 test/pdb_ligands_sdf/1v48_ha1.sdf
    3019 2020-05-08 17:41 test/pdb_ligands_sdf/4y5d_mt6.sdf
    2657 2020-05-08 17:41 test/pdb_ligands_sdf/1xxp_ptr.sdf
    2825 2020-05-08 17:41 test/pdb_ligands_sdf/4c38_vup.sdf
    1481 2020-05-08 17:41 test/pdb_ligands_sdf/3u3h_03w.sdf
    4337 2020-05-08 17:41 test/pdb_ligands_sdf/3blq_atp.sdf
    4475 2020-05-08 17:41 test/pdb_ligands_sdf/5ngb_8wh.sdf
    3936 2020-05-08 17:41 test/pdb_ligands_sdf/1gsz_r71.sdf
    3039 2020-05-08 17:41 test/pdb_ligands_sdf/3prz_3rz.sdf
    3475 2020-05-08 17:41 test/pdb_ligands_sdf/2xca_dgt.sdf
    4023 2020-05-08 17:41 test/pdb_ligands_sdf/5hu0_66h.sdf
    4356 2020-05-08 17:41 test/pdb_ligands_sdf/4tth_24v.sdf
    3476 2020-05-08 17:41 test/pdb_ligands_sdf/4qho_nkg.sdf
    2890 2020-05-08 17:41 test/pdb_ligands_sdf/2zvj_kom.sdf
    8862 2020-05-08 17:41 test/pdb_ligands_sdf/1xd1_6sa.sdf
    3006 2020-05-08 17:41 test/pdb_ligands_sdf/5alk_wmr.sdf
    2782 2020-05-08 17:41 test/pdb_ligands_sdf/1i2z_654.sdf
    6772 2020-05-08 17:41 test/pdb_ligands_sdf/4gvt_0sg.sdf
    5591 2020-05-08 17:41 test/pdb_ligands_sdf/3hvk_719.sdf
    1489 2020-05-08 17:41 test/pdb_ligands_sdf/4x36_cht.sdf
    2718 2020-05-08 17:41 test/pdb_ligands_sdf/3nly_h4b.sdf
    2388 2020-05-08 17:41 test/pdb_ligands_sdf/2nz5_226.sdf
    2202 2020-05-08 17:41 test/pdb_ligands_sdf/3e6k_abh.sdf
    3985 2020-05-08 17:41 test/pdb_ligands_sdf/5dcz_59b.sdf
    4707 2020-05-08 17:41 test/pdb_ligands_sdf/1xot_vdn.sdf
    3448 2020-05-08 17:41 test/pdb_ligands_sdf/3rti_fmp.sdf
    4625 2020-05-08 17:41 test/pdb_ligands_sdf/4udb_cv7.sdf
    2768 2020-05-08 17:41 test/pdb_ligands_sdf/1lcw_shm.sdf
    3083 2020-05-08 17:41 test/pdb_ligands_sdf/1ikx_pnu.sdf
    6563 2020-05-08 17:41 test/pdb_ligands_sdf/2xuf_tz4.sdf
    4473 2020-05-08 17:41 test/pdb_ligands_sdf/2bev_thy.sdf
    3917 2020-05-08 17:41 test/pdb_ligands_sdf/2wqo_vgk.sdf
    6476 2020-05-08 17:41 test/pdb_ligands_sdf/5hmi_62t.sdf
    1852 2020-05-08 17:41 test/pdb_ligands_sdf/1rfn_pbz.sdf
    2933 2020-05-08 17:41 test/pdb_ligands_sdf/1bx4_adn.sdf
    2304 2020-05-08 17:41 test/pdb_ligands_sdf/2bxn_myr.sdf
    3721 2020-05-08 17:41 test/pdb_ligands_sdf/5cx9_551.sdf
    4004 2020-05-08 17:41 test/pdb_ligands_sdf/5d7r_57y.sdf
    3636 2020-05-08 17:41 test/pdb_ligands_sdf/4tqp_48r.sdf
    3901 2020-05-08 17:41 test/pdb_ligands_sdf/3msc_24s.sdf
    4188 2020-05-08 17:41 test/pdb_ligands_sdf/3pne_8ax.sdf
    2894 2020-05-08 17:41 test/pdb_ligands_sdf/5ngs_8ww.sdf
    3903 2020-05-08 17:41 test/pdb_ligands_sdf/2g70_sam.sdf
    2212 2020-05-08 17:41 test/pdb_ligands_sdf/4u70_q04.sdf
    4715 2020-05-08 17:41 test/pdb_ligands_sdf/2ham_c33.sdf
    3105 2020-05-08 17:41 test/pdb_ligands_sdf/5auu_lu2.sdf
    5897 2020-05-08 17:41 test/pdb_ligands_sdf/1s14_nov.sdf
    1991 2020-05-08 17:41 test/pdb_ligands_sdf/1oim_noj.sdf
    3009 2020-05-08 17:41 test/pdb_ligands_sdf/5abf_xrj.sdf
    2985 2020-05-08 17:41 test/pdb_ligands_sdf/5mt4_m7o.sdf
    3194 2020-05-08 17:41 test/pdb_ligands_sdf/1jvu_c2p.sdf
    5900 2020-05-08 17:41 test/pdb_ligands_sdf/5i3m_67f.sdf
    4652 2020-05-08 17:41 test/pdb_ligands_sdf/3oe4_610.sdf
    2690 2020-05-08 17:41 test/pdb_ligands_sdf/4wh9_3m8.sdf
    4688 2020-05-08 17:41 test/pdb_ligands_sdf/1c72_epy.sdf
    5082 2020-05-08 17:41 test/pdb_ligands_sdf/4hyf_1ak.sdf
    3696 2020-05-08 17:41 test/pdb_ligands_sdf/2brg_dfy.sdf
    3064 2020-05-08 17:41 test/pdb_ligands_sdf/3frb_top.sdf
    4394 2020-05-08 17:41 test/pdb_ligands_sdf/5kzi_6yn.sdf
    3070 2020-05-08 17:41 test/pdb_ligands_sdf/4c4g_7pe.sdf
    4596 2020-05-08 17:41 test/pdb_ligands_sdf/3sgx_0fw.sdf
    5117 2020-05-08 17:41 test/pdb_ligands_sdf/4zr5_rdf.sdf
    2628 2020-05-08 17:41 test/pdb_ligands_sdf/4zum_fks.sdf
    2006 2020-05-08 17:41 test/pdb_ligands_sdf/2b7p_pht.sdf
    5110 2020-05-08 17:41 test/pdb_ligands_sdf/4ces_nfw.sdf
    3908 2020-05-08 17:41 test/pdb_ligands_sdf/2ym8_ym8.sdf
    5342 2020-05-08 17:41 test/pdb_ligands_sdf/2vwc_bc2.sdf
    6174 2020-05-08 17:41 test/pdb_ligands_sdf/1r3y_cp3.sdf
    4137 2020-05-08 17:41 test/pdb_ligands_sdf/2vdm_agg.sdf
    2419 2020-05-08 17:41 test/pdb_ligands_sdf/4kvi_1sv.sdf
    2901 2020-05-08 17:41 test/pdb_ligands_sdf/5ikq_jms.sdf
    4016 2020-05-08 17:41 test/pdb_ligands_sdf/3ps1_zh2.sdf
    4502 2020-05-08 17:41 test/pdb_ligands_sdf/5wkg_cuy.sdf
    3405 2020-05-08 17:41 test/pdb_ligands_sdf/3zt6_mal.sdf
    4327 2020-05-08 17:41 test/pdb_ligands_sdf/4at4_t6e.sdf
    4189 2020-05-08 17:41 test/pdb_ligands_sdf/4ims_12s.sdf
    3793 2020-05-08 17:41 test/pdb_ligands_sdf/1ou6_168.sdf
    4343 2020-05-08 17:41 test/pdb_ligands_sdf/5on0_9yh.sdf
    3509 2020-05-08 17:41 test/pdb_ligands_sdf/3weg_fps.sdf
    3202 2020-05-08 17:41 test/pdb_ligands_sdf/1dvj_up6.sdf
    3756 2020-05-08 17:41 test/pdb_ligands_sdf/5onh_vrt.sdf
    2715 2020-05-08 17:41 test/pdb_ligands_sdf/3ipx_b86.sdf
    4583 2020-05-08 17:41 test/pdb_ligands_sdf/4q18_2xj.sdf
    5538 2020-05-08 17:41 test/pdb_ligands_sdf/5kmb_6ut.sdf
    2898 2020-05-08 17:41 test/pdb_ligands_sdf/4ucd_m81.sdf
    1622 2020-05-08 17:41 test/pdb_ligands_sdf/3tx9_3rn.sdf
    4718 2020-05-08 17:41 test/pdb_ligands_sdf/3cbl_stu.sdf
    4404 2020-05-08 17:41 test/pdb_ligands_sdf/4o3q_xg4.sdf
    3629 2020-05-08 17:41 test/pdb_ligands_sdf/4nx4_jpr.sdf
    3518 2020-05-08 17:41 test/pdb_ligands_sdf/2q8i_rdc.sdf
    2581 2020-05-08 17:41 test/pdb_ligands_sdf/3pa9_pmp.sdf
    4244 2020-05-08 17:41 test/pdb_ligands_sdf/4eox_0s5.sdf
    2045 2020-05-08 17:41 test/pdb_ligands_sdf/4iw1_fud.sdf
    3155 2020-05-08 17:41 test/pdb_ligands_sdf/4ktk_ktk.sdf
    3607 2020-05-08 17:41 test/pdb_ligands_sdf/1ebm_8og.sdf
    2569 2020-05-08 17:41 test/pdb_ligands_sdf/2no9_ltt.sdf
    6184 2020-05-08 17:41 test/pdb_ligands_sdf/5wb6_9zm.sdf
    1959 2020-05-08 17:41 test/pdb_ligands_sdf/5io7_d12.sdf
    3203 2020-05-08 17:41 test/pdb_ligands_sdf/3ma3_01i.sdf
    3830 2020-05-08 17:41 test/pdb_ligands_sdf/2wd2_ms5.sdf
    1826 2020-05-08 17:41 test/pdb_ligands_sdf/2i30_sal.sdf
    3021 2020-05-08 17:41 test/pdb_ligands_sdf/3kfy_jzm.sdf
    1685 2020-05-08 17:41 test/pdb_ligands_sdf/3dkl_unu.sdf
    2241 2020-05-08 17:41 test/pdb_ligands_sdf/4g5f_0jd.sdf
    2439 2020-05-08 17:41 test/pdb_ligands_sdf/5g3u_itw.sdf
    3405 2020-05-08 17:41 test/pdb_ligands_sdf/5ghz_ced.sdf
    6362 2020-05-08 17:41 test/pdb_ligands_sdf/1kzn_cbn.sdf
    3416 2020-05-08 17:41 test/pdb_ligands_sdf/3cj3_sx4.sdf
    4466 2020-05-08 17:41 test/pdb_ligands_sdf/5eqh_5rf.sdf
    2069 2020-05-08 17:41 test/pdb_ligands_sdf/4wqj_36y.sdf
    3428 2020-05-08 17:41 test/pdb_ligands_sdf/4zvk_et.sdf
    1160 2020-05-08 17:41 test/pdb_ligands_sdf/1vdv_mos.sdf
    3639 2020-05-08 17:41 test/pdb_ligands_sdf/3t7m_udp.sdf
    2944 2020-05-08 17:41 test/pdb_ligands_sdf/2dkd_ng1.sdf
    3397 2020-05-08 17:41 test/pdb_ligands_sdf/1bq4_bhc.sdf
    2556 2020-05-08 17:41 test/pdb_ligands_sdf/2o0e_s3p.sdf
    3181 2020-05-08 17:41 test/pdb_ligands_sdf/2pe5_145.sdf
    5799 2020-05-08 17:41 test/pdb_ligands_sdf/4ug5_hem.sdf
    3531 2020-05-08 17:41 test/pdb_ligands_sdf/3ntg_d72.sdf
    5954 2020-05-08 17:41 test/pdb_ligands_sdf/5q0f_9fa.sdf
    3290 2020-05-08 17:41 test/pdb_ligands_sdf/5l1w_7pf.sdf
    3508 2020-05-08 17:41 test/pdb_ligands_sdf/1l2j_etc.sdf
    2293 2020-05-08 17:41 test/pdb_ligands_sdf/4urv_umk.sdf
    4857 2020-05-08 17:41 test/pdb_ligands_sdf/5eym_5u5.sdf
    3966 2020-05-08 17:41 test/pdb_ligands_sdf/5btd_gfn.sdf
    1605 2020-05-08 17:41 test/pdb_ligands_sdf/1qiz_rco.sdf
    4215 2020-05-08 17:41 test/pdb_ligands_sdf/5dlt_5jk.sdf
    5701 2020-05-08 17:41 test/pdb_ligands_sdf/5gjf_6v4.sdf
    2573 2020-05-08 17:41 test/pdb_ligands_sdf/1tip_f6p.sdf
    4166 2020-05-08 17:41 test/pdb_ligands_sdf/4isf_1fx.sdf
    3027 2020-05-08 17:41 test/pdb_ligands_sdf/4y0q_px9.sdf
    1696 2020-05-08 17:41 test/pdb_ligands_sdf/1l5m_nio.sdf
    3554 2020-05-08 17:41 test/pdb_ligands_sdf/1arh_ppd.sdf
    3409 2020-05-08 17:41 test/pdb_ligands_sdf/4yv5_pe4.sdf
    4955 2020-05-08 17:41 test/pdb_ligands_sdf/5bt3_2lo.sdf
    3742 2020-05-08 17:41 test/pdb_ligands_sdf/1o6q_r17.sdf
    3671 2020-05-08 17:41 test/pdb_ligands_sdf/3dz2_a8m.sdf
    4895 2020-05-08 17:41 test/pdb_ligands_sdf/4zzh_4to.sdf
    4225 2020-05-08 17:41 test/pdb_ligands_sdf/3nox_6a5.sdf
    2530 2020-05-08 17:41 test/pdb_ligands_sdf/4r5m_4no.sdf
    3526 2020-05-08 17:41 test/pdb_ligands_sdf/4ran_3l6.sdf
    3687 2020-05-08 17:41 test/pdb_ligands_sdf/4iju_1eo.sdf
    1486 2020-05-08 17:41 test/pdb_ligands_sdf/5mfs_mli.sdf
    6648 2020-05-08 17:41 test/pdb_ligands_sdf/4hur_aco.sdf
    4480 2020-05-08 17:41 test/pdb_ligands_sdf/4mwo_2e2.sdf
    1351 2020-05-08 17:41 test/pdb_ligands_sdf/2oz0_pyr.sdf
    3265 2020-05-08 17:41 test/pdb_ligands_sdf/3bz9_bl7.sdf
    5341 2020-05-08 17:41 test/pdb_ligands_sdf/4xdm_gdm.sdf
    4968 2020-05-08 17:41 test/pdb_ligands_sdf/4ogv_2u7.sdf
    2448 2020-05-08 17:41 test/pdb_ligands_sdf/4xjo_plp.sdf
    4386 2020-05-08 17:41 test/pdb_ligands_sdf/2xo8_ad9.sdf
    4305 2020-05-08 17:41 test/pdb_ligands_sdf/1pqc_444.sdf
    2197 2020-05-08 17:41 test/pdb_ligands_sdf/3ijj_en1.sdf
    2018 2020-05-08 17:41 test/pdb_ligands_sdf/2j75_noy.sdf
    3433 2020-05-08 17:41 test/pdb_ligands_sdf/4fa6_0ta.sdf
    4416 2020-05-08 17:41 test/pdb_ligands_sdf/3tfj_thg.sdf
    3501 2020-05-08 17:41 test/pdb_ligands_sdf/1jcs_fii.sdf
    5157 2020-05-08 17:41 test/pdb_ligands_sdf/3djk_g55.sdf
    2888 2020-05-08 17:41 test/pdb_ligands_sdf/2zi6_3d1.sdf
    1827 2020-05-08 17:41 test/pdb_ligands_sdf/5fym_2hg.sdf
    5325 2020-05-08 17:41 test/pdb_ligands_sdf/4lgu_1yh.sdf
    2824 2020-05-08 17:41 test/pdb_ligands_sdf/2ikh_lit.sdf
    5510 2020-05-08 17:41 test/pdb_ligands_sdf/4u8w_g10.sdf
    1600 2020-05-08 17:41 test/pdb_ligands_sdf/1l5r_mrd.sdf
    2147 2020-05-08 17:41 test/pdb_ligands_sdf/3t39_skm.sdf
    2034 2020-05-08 17:41 test/pdb_ligands_sdf/4kic_ppy.sdf
    4799 2020-05-08 17:41 test/pdb_ligands_sdf/3k5k_dxq.sdf
    5466 2020-05-08 17:41 test/pdb_ligands_sdf/5k3y_6q4.sdf
    2771 2020-05-08 17:41 test/pdb_ligands_sdf/2ooh_ox3.sdf
    4950 2020-05-08 17:41 test/pdb_ligands_sdf/5foi_my8.sdf
    4602 2020-05-08 17:41 test/pdb_ligands_sdf/2j6m_aee.sdf
    6439 2020-05-08 17:41 test/pdb_ligands_sdf/5hi4_63p.sdf
    4223 2020-05-08 17:41 test/pdb_ligands_sdf/2z3i_bls.sdf
    3856 2020-05-08 17:41 test/pdb_ligands_sdf/1s9j_bbm.sdf
    3860 2020-05-08 17:41 test/pdb_ligands_sdf/5vsc_9hj.sdf
    5329 2020-05-08 17:41 test/pdb_ligands_sdf/4khm_1pv.sdf
    1934 2020-05-08 17:41 test/pdb_ligands_sdf/2inz_ohp.sdf
    6063 2020-05-08 17:41 test/pdb_ligands_sdf/5p9g_7g6.sdf
    2514 2020-05-08 17:41 test/pdb_ligands_sdf/3o2y_plm.sdf
    3620 2020-05-08 17:41 test/pdb_ligands_sdf/1hb1_ocv.sdf
    2098 2020-05-08 17:41 test/pdb_ligands_sdf/4k8a_k8a.sdf
    3468 2020-05-08 17:41 test/pdb_ligands_sdf/1e90_myc.sdf
    1395 2020-05-08 17:41 test/pdb_ligands_sdf/3v5a_abu.sdf
    2018 2020-05-08 17:41 test/pdb_ligands_sdf/3scs_glf.sdf
    3835 2020-05-08 17:41 test/pdb_ligands_sdf/3vha_vha.sdf
    3754 2020-05-08 17:41 test/pdb_ligands_sdf/1olx_tdp.sdf
    3761 2020-05-08 17:41 test/pdb_ligands_sdf/2pvl_p55.sdf
    4992 2020-05-08 17:41 test/pdb_ligands_sdf/1hrn_03d.sdf
    3914 2020-05-08 17:41 test/pdb_ligands_sdf/5kma_777.sdf
    3180 2020-05-08 17:41 test/pdb_ligands_sdf/2w5u_ic3.sdf
    3102 2020-05-08 17:41 test/pdb_ligands_sdf/1o35_802.sdf
    3529 2020-05-08 17:41 test/pdb_ligands_sdf/4r5t_r5t.sdf
    3875 2020-05-08 17:41 test/pdb_ligands_sdf/3fr4_f8a.sdf
    4752 2020-05-08 17:41 test/pdb_ligands_sdf/3zxi_tya.sdf
    3899 2020-05-08 17:41 test/pdb_ligands_sdf/5d12_g97.sdf
    2486 2020-05-08 17:41 test/pdb_ligands_sdf/2pd4_dcn.sdf
    3778 2020-05-08 17:41 test/pdb_ligands_sdf/3qls_55v.sdf
     638 2020-05-08 17:41 test/pdb_ligands_sdf/1ueh_unl.sdf
    4127 2020-05-08 17:41 test/pdb_ligands_sdf/5drq_5em.sdf
    5849 2020-05-08 17:41 test/pdb_ligands_sdf/5dgw_5b5.sdf
    2771 2020-05-08 17:41 test/pdb_ligands_sdf/3c56_ph4.sdf
    4117 2020-05-08 17:41 test/pdb_ligands_sdf/2oh0_2py.sdf
    2772 2020-05-08 17:41 test/pdb_ligands_sdf/1lpp_hds.sdf
    4401 2020-05-08 17:41 test/pdb_ligands_sdf/2bed_736.sdf
    3553 2020-05-08 17:41 test/pdb_ligands_sdf/1ro9_8br.sdf
    3596 2020-05-08 17:41 test/pdb_ligands_sdf/5upv_8kv.sdf
    4112 2020-05-08 17:41 test/pdb_ligands_sdf/1nb6_utp.sdf
    3712 2020-05-08 17:41 test/pdb_ligands_sdf/5lbw_v0l.sdf
    4841 2020-05-08 17:41 test/pdb_ligands_sdf/3ntz_3tz.sdf
    3930 2020-05-08 17:41 test/pdb_ligands_sdf/3b3p_ji7.sdf
    1868 2020-05-08 17:41 test/pdb_ligands_sdf/3v0r_0fu.sdf
    3651 2020-05-08 17:41 test/pdb_ligands_sdf/4o0y_2oo.sdf
    4436 2020-05-08 17:41 test/pdb_ligands_sdf/4keb_1qz.sdf
    3463 2020-05-08 17:41 test/pdb_ligands_sdf/2bdm_tmi.sdf
    4309 2020-05-08 17:41 test/pdb_ligands_sdf/3dj5_ak5.sdf
    4484 2020-05-08 17:41 test/pdb_ligands_sdf/1mmb_bat.sdf
    5771 2020-05-08 17:41 test/pdb_ligands_sdf/5o91_c5n.sdf
    3892 2020-05-08 17:41 test/pdb_ligands_sdf/3w7k_w7k.sdf
    3047 2020-05-08 17:41 test/pdb_ligands_sdf/1w6y_equ.sdf
    2119 2020-05-08 17:41 test/pdb_ligands_sdf/1c5y_esp.sdf
    2204 2020-05-08 17:41 test/pdb_ligands_sdf/1g67_tzp.sdf
    2907 2020-05-08 17:41 test/pdb_ligands_sdf/4ryz_a5v.sdf
    8214 2020-05-08 17:41 test/pdb_ligands_sdf/3bvw_wz4.sdf
    4494 2020-05-08 17:41 test/pdb_ligands_sdf/4znt_obb.sdf
    4437 2020-05-08 17:41 test/pdb_ligands_sdf/4ej4_ej4.sdf
    6870 2020-05-08 17:41 test/pdb_ligands_sdf/2fxe_dr7.sdf
    3202 2020-05-08 17:41 test/pdb_ligands_sdf/1z7j_t4a.sdf
    4185 2020-05-08 17:41 test/pdb_ligands_sdf/4tsq_hxg.sdf
    2104 2020-05-08 17:41 test/pdb_ligands_sdf/1v5y_4hc.sdf
    5034 2020-05-08 17:41 test/pdb_ligands_sdf/5ct7_55j.sdf
    3534 2020-05-08 17:41 test/pdb_ligands_sdf/2fme_3qc.sdf
    3669 2020-05-08 17:41 test/pdb_ligands_sdf/4k5g_q13.sdf
    4031 2020-05-08 17:41 test/pdb_ligands_sdf/5upg_8gj.sdf
    3216 2020-05-08 17:41 test/pdb_ligands_sdf/4ein_noh.sdf
    3771 2020-05-08 17:41 test/pdb_ligands_sdf/4fkj_11k.sdf
    3114 2020-05-08 17:41 test/pdb_ligands_sdf/3ba8_3b8.sdf
    3215 2020-05-08 17:41 test/pdb_ligands_sdf/5tht_b3n.sdf
    1689 2020-05-08 17:41 test/pdb_ligands_sdf/1j14_ben.sdf
    4443 2020-05-08 17:41 test/pdb_ligands_sdf/1hfp_mot.sdf
    3169 2020-05-08 17:41 test/pdb_ligands_sdf/4y67_rc5.sdf
    4667 2020-05-08 17:41 test/pdb_ligands_sdf/5egu_5nq.sdf
    4347 2020-05-08 17:41 test/pdb_ligands_sdf/3g8i_ro7.sdf
    4047 2020-05-08 17:41 test/pdb_ligands_sdf/5vt4_9kj.sdf
    1809 2020-05-08 17:41 test/pdb_ligands_sdf/1khf_pep.sdf
    2351 2020-05-08 17:41 test/pdb_ligands_sdf/3t5i_far.sdf
    4908 2020-05-08 17:41 test/pdb_ligands_sdf/4ztj_4rt.sdf
    1916 2020-05-08 17:41 test/pdb_ligands_sdf/4rrt_3v4.sdf
    4553 2020-05-08 17:41 test/pdb_ligands_sdf/2rgp_hyz.sdf
    3380 2020-05-08 17:41 test/pdb_ligands_sdf/5aqz_sgv.sdf
    2089 2020-05-08 17:41 test/pdb_ligands_sdf/4y4j_lnr.sdf
    3954 2020-05-08 17:41 test/pdb_ligands_sdf/4btl_5gz.sdf
    3879 2020-05-08 17:41 test/pdb_ligands_sdf/3t7q_rb4.sdf
    1381 2020-05-08 17:41 test/pdb_ligands_sdf/3ovv_bud.sdf
    5962 2020-05-08 17:41 test/pdb_ligands_sdf/5vl0_nai.sdf
    2744 2020-05-08 17:41 test/pdb_ligands_sdf/5ml0_p2l.sdf
    3842 2020-05-08 17:41 test/pdb_ligands_sdf/1mog_rbf.sdf
    4137 2020-05-08 17:41 test/pdb_ligands_sdf/5kz0_6yl.sdf
    4747 2020-05-08 17:41 test/pdb_ligands_sdf/1thl_0db.sdf
    4508 2020-05-08 17:41 test/pdb_ligands_sdf/5n2d_8j8.sdf
    4789 2020-05-08 17:41 test/pdb_ligands_sdf/4pv5_cbw.sdf
    2332 2020-05-08 17:41 test/pdb_ligands_sdf/3oax_id3.sdf
    2760 2020-05-08 17:41 test/pdb_ligands_sdf/4c4t_grx.sdf
    2929 2020-05-08 17:41 test/pdb_ligands_sdf/1fpi_ahg.sdf
    1382 2020-05-08 17:41 test/pdb_ligands_sdf/3f66_gbl.sdf
    3519 2020-05-08 17:41 test/pdb_ligands_sdf/4ph4_2ug.sdf
    3844 2020-05-08 17:41 test/pdb_ligands_sdf/2yy1_nlc.sdf
    1829 2020-05-08 17:41 test/pdb_ligands_sdf/2v2a_13p.sdf
    3957 2020-05-08 17:41 test/pdb_ligands_sdf/5a5j_6yf.sdf
    3205 2020-05-08 17:41 test/pdb_ligands_sdf/4m81_pnw.sdf
    2066 2020-05-08 17:41 test/pdb_ligands_sdf/2vpo_6cs.sdf
    2173 2020-05-08 17:41 test/pdb_ligands_sdf/1uw6_nct.sdf
    4149 2020-05-08 17:41 test/pdb_ligands_sdf/4kxn_6k6.sdf
    4551 2020-05-08 17:41 test/pdb_ligands_sdf/1ove_358.sdf
    4251 2020-05-08 17:41 test/pdb_ligands_sdf/1w29_ts1.sdf
    4197 2020-05-08 17:41 test/pdb_ligands_sdf/2q5l_s1t.sdf
    2598 2020-05-08 17:41 test/pdb_ligands_sdf/4mqf_2bq.sdf
    4177 2020-05-08 17:41 test/pdb_ligands_sdf/3wcl_bh3.sdf
    2414 2020-05-08 17:41 test/pdb_ligands_sdf/4mta_2d2.sdf
    7032 2020-05-08 17:41 test/pdb_ligands_sdf/4zhf_4ol.sdf
    2329 2020-05-08 17:41 test/pdb_ligands_sdf/2hb1_512.sdf
    5472 2020-05-08 17:41 test/pdb_ligands_sdf/2p4i_mr9.sdf
    1444 2020-05-08 17:41 test/pdb_ligands_sdf/3ms3_anl.sdf
    5229 2020-05-08 17:41 test/pdb_ligands_sdf/4z36_on3.sdf
    4325 2020-05-08 17:41 test/pdb_ligands_sdf/1w83_l11.sdf
    1819 2020-05-08 17:41 test/pdb_ligands_sdf/5e97_npo.sdf
    3865 2020-05-08 17:41 test/pdb_ligands_sdf/3zbx_6xe.sdf
    4887 2020-05-08 17:41 test/pdb_ligands_sdf/2g28_tdk.sdf
    6218 2020-05-08 17:41 test/pdb_ligands_sdf/4f5y_c2e.sdf
    3039 2020-05-08 17:41 test/pdb_ligands_sdf/4c1i_eh9.sdf
    3946 2020-05-08 17:41 test/pdb_ligands_sdf/2fxs_rda.sdf
    5954 2020-05-08 17:41 test/pdb_ligands_sdf/1dfi_nad.sdf
    2200 2020-05-08 17:41 test/pdb_ligands_sdf/2af9_dao.sdf
    2818 2020-05-08 17:41 test/pdb_ligands_sdf/1mrk_fmc.sdf
    5439 2020-05-08 17:41 test/pdb_ligands_sdf/5vpm_9g7.sdf
    4120 2020-05-08 17:41 test/pdb_ligands_sdf/3ksl_szh.sdf
    2766 2020-05-08 17:41 test/pdb_ligands_sdf/3ijj_avr.sdf
    3752 2020-05-08 17:41 test/pdb_ligands_sdf/4ft7_h3k.sdf
    4412 2020-05-08 17:41 test/pdb_ligands_sdf/3way_dwy.sdf
    4856 2020-05-08 17:41 test/pdb_ligands_sdf/3bkk_kaf.sdf
    2667 2020-05-08 17:41 test/pdb_ligands_sdf/5sux_70h.sdf
    3106 2020-05-08 17:41 test/pdb_ligands_sdf/1rbo_cap.sdf
    4864 2020-05-08 17:41 test/pdb_ligands_sdf/4ly9_1yy.sdf
    1722 2020-05-08 17:41 test/pdb_ligands_sdf/1h7x_urf.sdf
    3131 2020-05-08 17:41 test/pdb_ligands_sdf/4oql_f2u.sdf
    3764 2020-05-08 17:41 test/pdb_ligands_sdf/4k0y_1oa.sdf
    2059 2020-05-08 17:41 test/pdb_ligands_sdf/5aqq_bbw.sdf
    4583 2020-05-08 17:41 test/pdb_ligands_sdf/4dob_grc.sdf
    3395 2020-05-08 17:41 test/pdb_ligands_sdf/3v5u_olc.sdf
    3387 2020-05-08 17:41 test/pdb_ligands_sdf/4d96_5pa.sdf
    2839 2020-05-08 17:41 test/pdb_ligands_sdf/2wyp_kdn.sdf
    4712 2020-05-08 17:41 test/pdb_ligands_sdf/4kcm_1qf.sdf
    3610 2020-05-08 17:41 test/pdb_ligands_sdf/1b9v_ra2.sdf
    2775 2020-05-08 17:41 test/pdb_ligands_sdf/1dww_h2b.sdf
    3022 2020-05-08 17:41 test/pdb_ligands_sdf/3u9f_clm.sdf
    4982 2020-05-08 17:41 test/pdb_ligands_sdf/2y1x_845.sdf
    2325 2020-05-08 17:41 test/pdb_ligands_sdf/3n1w_3n2.sdf
    3047 2020-05-08 17:41 test/pdb_ligands_sdf/4ovl_1td.sdf
    5740 2020-05-08 17:41 test/pdb_ligands_sdf/5hu9_66k.sdf
    4636 2020-05-08 17:41 test/pdb_ligands_sdf/4knb_1ru.sdf
    2154 2020-05-08 17:41 test/pdb_ligands_sdf/3ty3_ggg.sdf
    3625 2020-05-08 17:41 test/pdb_ligands_sdf/4ibm_ir1.sdf
    2075 2020-05-08 17:41 test/pdb_ligands_sdf/5jnc_6lh.sdf
    5617 2020-05-08 17:41 test/pdb_ligands_sdf/5gic_dlc.sdf
    1817 2020-05-08 17:41 test/pdb_ligands_sdf/1giu_ade.sdf
    2558 2020-05-08 17:41 test/pdb_ligands_sdf/2yxn_azy.sdf
    3649 2020-05-08 17:41 test/pdb_ligands_sdf/4wtc_cdp.sdf
    2314 2020-05-08 17:41 test/pdb_ligands_sdf/1so3_tx4.sdf
    2450 2020-05-08 17:41 test/pdb_ligands_sdf/3o3j_bb4.sdf
    2427 2020-05-08 17:41 test/pdb_ligands_sdf/1mau_ltn.sdf
    4402 2020-05-08 17:41 test/pdb_ligands_sdf/2pjt_347.sdf
    3161 2020-05-08 17:41 test/pdb_ligands_sdf/1pcw_h4p.sdf
    3172 2020-05-08 17:41 test/pdb_ligands_sdf/1lcb_tmp.sdf
    3362 2020-05-08 17:41 test/pdb_ligands_sdf/4qab_kk2.sdf
    1837 2020-05-08 17:41 test/pdb_ligands_sdf/3oem_oem.sdf
    1912 2020-05-08 17:41 test/pdb_ligands_sdf/5em3_5q0.sdf
    3871 2020-05-08 17:41 test/pdb_ligands_sdf/1cg4_imo.sdf
    2040 2020-05-08 17:41 test/pdb_ligands_sdf/3tv8_dgj.sdf
    3615 2020-05-08 17:41 test/pdb_ligands_sdf/3fc8_ifa.sdf
    1819 2020-05-08 17:41 test/pdb_ligands_sdf/3ms5_oga.sdf
    4555 2020-05-08 17:41 test/pdb_ligands_sdf/5f91_5wj.sdf
    5330 2020-05-08 17:41 test/pdb_ligands_sdf/5imx_cz4.sdf
    1708 2020-05-08 17:41 test/pdb_ligands_sdf/5fyv_oaa.sdf
    3366 2020-05-08 17:41 test/pdb_ligands_sdf/5c7c_4yc.sdf
    5689 2020-05-08 17:41 test/pdb_ligands_sdf/1t7k_bh0.sdf
    3129 2020-05-08 17:41 test/pdb_ligands_sdf/3zl2_bwg.sdf
    4077 2020-05-08 17:41 test/pdb_ligands_sdf/3bl9_dd2.sdf
    3733 2020-05-08 17:41 test/pdb_ligands_sdf/4ug6_xfj.sdf
    2075 2020-05-08 17:41 test/pdb_ligands_sdf/5d9w_asc.sdf
    1807 2020-05-08 17:41 test/pdb_ligands_sdf/2buw_phb.sdf
    4709 2020-05-08 17:41 test/pdb_ligands_sdf/4dig_mu2.sdf
    4581 2020-05-08 17:41 test/pdb_ligands_sdf/6cpa_zaf.sdf
    4370 2020-05-08 17:41 test/pdb_ligands_sdf/2bz6_346.sdf
    3288 2020-05-08 17:41 test/pdb_ligands_sdf/4wbo_anw.sdf
    4197 2020-05-08 17:41 test/pdb_ligands_sdf/3cwe_825.sdf
    1984 2020-05-08 17:41 test/pdb_ligands_sdf/4u69_q07.sdf
    2474 2020-05-08 17:41 test/pdb_ligands_sdf/1dgp_foh.sdf
    3241 2020-05-08 17:41 test/pdb_ligands_sdf/1tl3_h20.sdf
    4906 2020-05-08 17:41 test/pdb_ligands_sdf/5dry_5ek.sdf
    4042 2020-05-08 17:41 test/pdb_ligands_sdf/2yni_cxd.sdf
    4409 2020-05-08 17:41 test/pdb_ligands_sdf/2vn0_tdz.sdf
    3285 2020-05-08 17:41 test/pdb_ligands_sdf/1t64_tsn.sdf
    5929 2020-05-08 17:41 test/pdb_ligands_sdf/4ycm_7bs.sdf
    1627 2020-05-08 17:41 test/pdb_ligands_sdf/5c7v_pyc.sdf
    4064 2020-05-08 17:41 test/pdb_ligands_sdf/2vwv_7x3.sdf
    3399 2020-05-08 17:41 test/pdb_ligands_sdf/5hvb_65o.sdf
    2037 2020-05-08 17:41 test/pdb_ligands_sdf/1bke_b3i.sdf
    3505 2020-05-08 17:41 test/pdb_ligands_sdf/2ydi_ydi.sdf
    3944 2020-05-08 17:41 test/pdb_ligands_sdf/5e2m_v14.sdf
    3023 2020-05-08 17:41 test/pdb_ligands_sdf/5dax_58l.sdf
    1586 2020-05-08 17:41 test/pdb_ligands_sdf/1lde_fpi.sdf
    1956 2020-05-08 17:41 test/pdb_ligands_sdf/4y5a_47m.sdf
    3183 2020-05-08 17:41 test/pdb_ligands_sdf/4i85_h50.sdf
    2830 2020-05-08 17:41 test/pdb_ligands_sdf/4oqn_edu.sdf
    6071 2020-05-08 17:41 test/pdb_ligands_sdf/4dfk_0l5.sdf
    2686 2020-05-08 17:41 test/pdb_ligands_sdf/2azr_982.sdf
    3378 2020-05-08 17:41 test/pdb_ligands_sdf/5unv_8j7.sdf
    3835 2020-05-08 17:41 test/pdb_ligands_sdf/1eko_i84.sdf
    2172 2020-05-08 17:41 test/pdb_ligands_sdf/4lm1_7ze.sdf
    2129 2020-05-08 17:41 test/pdb_ligands_sdf/5fzh_0ti.sdf
    4315 2020-05-08 17:41 test/pdb_ligands_sdf/4ach_kdi.sdf
    3232 2020-05-08 17:41 test/pdb_ligands_sdf/1ikv_efz.sdf
    1583 2020-05-08 17:41 test/pdb_ligands_sdf/5n84_pg0.sdf
    3395 2020-05-08 17:41 test/pdb_ligands_sdf/4dhu_0kh.sdf
    3251 2020-05-08 17:41 test/pdb_ligands_sdf/4car_m87.sdf
    4663 2020-05-08 17:41 test/pdb_ligands_sdf/4py0_6at.sdf
    2293 2020-05-08 17:41 test/pdb_ligands_sdf/4xaq_40f.sdf
    6643 2020-05-08 17:41 test/pdb_ligands_sdf/2a4r_bnh.sdf
    3549 2020-05-08 17:41 test/pdb_ligands_sdf/3iak_ev1.sdf
    4445 2020-05-08 17:41 test/pdb_ligands_sdf/3o23_mqy.sdf
    2794 2020-05-08 17:41 test/pdb_ligands_sdf/5kh7_6t7.sdf
    3663 2020-05-08 17:41 test/pdb_ligands_sdf/3q6x_zz7.sdf
    4373 2020-05-08 17:41 test/pdb_ligands_sdf/4dpd_dhf.sdf
    4439 2020-05-08 17:41 test/pdb_ligands_sdf/5p99_77m.sdf
    3791 2020-05-08 17:41 test/pdb_ligands_sdf/3l9n_l9n.sdf
    1625 2020-05-08 17:41 test/pdb_ligands_sdf/5lgp_lpd.sdf
    3617 2020-05-08 17:41 test/pdb_ligands_sdf/1lol_xmp.sdf
    3688 2020-05-08 17:41 test/pdb_ligands_sdf/4rrq_a3s.sdf
    4981 2020-05-08 17:41 test/pdb_ligands_sdf/5ae9_oko.sdf
    1696 2020-05-08 17:41 test/pdb_ligands_sdf/5ktp_itn.sdf
    3274 2020-05-08 17:41 test/pdb_ligands_sdf/3sms_rnh.sdf
    2810 2020-05-08 17:41 test/pdb_ligands_sdf/5am9_p6g.sdf
    4436 2020-05-08 17:41 test/pdb_ligands_sdf/1u4g_hpi.sdf
    3149 2020-05-08 17:41 test/pdb_ligands_sdf/4ie7_rhn.sdf
    2867 2020-05-08 17:41 test/pdb_ligands_sdf/4eiy_ola.sdf
    3581 2020-05-08 17:41 test/pdb_ligands_sdf/3zxr_iq1.sdf
    3875 2020-05-08 17:41 test/pdb_ligands_sdf/3p3g_3p3.sdf
    6178 2020-05-08 17:41 test/pdb_ligands_sdf/5qbz_b8y.sdf
    3538 2020-05-08 17:41 test/pdb_ligands_sdf/3g5h_ytt.sdf
    4382 2020-05-08 17:41 test/pdb_ligands_sdf/3coy_53h.sdf
    4107 2020-05-08 17:41 test/pdb_ligands_sdf/5vsf_9hg.sdf
    4314 2020-05-08 17:41 test/pdb_ligands_sdf/4yax_4ae.sdf
    4958 2020-05-08 17:41 test/pdb_ligands_sdf/5q15_9mp.sdf
    3432 2020-05-08 17:41 test/pdb_ligands_sdf/3e6o_a55.sdf
    4154 2020-05-08 17:41 test/pdb_ligands_sdf/4i9n_1e6.sdf
    4999 2020-05-08 17:41 test/pdb_ligands_sdf/2cng_ize.sdf
    3305 2020-05-08 17:41 test/pdb_ligands_sdf/1nmx_fdm.sdf
    6894 2020-05-08 17:41 test/pdb_ligands_sdf/1jkx_138.sdf
    2002 2020-05-08 17:41 test/pdb_ligands_sdf/5f6y_5vm.sdf
    4088 2020-05-08 17:41 test/pdb_ligands_sdf/4nld_2n5.sdf
    1981 2020-05-08 17:41 test/pdb_ligands_sdf/3kr2_et2.sdf
    3081 2020-05-08 17:41 test/pdb_ligands_sdf/1lca_ump.sdf
    4783 2020-05-08 17:41 test/pdb_ligands_sdf/2rl5_2rl.sdf
    4209 2020-05-08 17:41 test/pdb_ligands_sdf/5xy1_8h0.sdf
    3985 2020-05-08 17:41 test/pdb_ligands_sdf/4eqg_a5a.sdf
    3180 2020-05-08 17:41 test/pdb_ligands_sdf/5cl0_u5p.sdf
    4014 2020-05-08 17:41 test/pdb_ligands_sdf/5c4e_4ya.sdf
    3337 2020-05-08 17:41 test/pdb_ligands_sdf/2vrj_ncw.sdf
    3718 2020-05-08 17:41 test/pdb_ligands_sdf/5tft_p6u.sdf
    2201 2020-05-08 17:41 test/pdb_ligands_sdf/1azm_azm.sdf
    3423 2020-05-08 17:41 test/pdb_ligands_sdf/4yde_4c7.sdf
    2853 2020-05-08 17:41 test/pdb_ligands_sdf/1men_gar.sdf
    3953 2020-05-08 17:41 test/pdb_ligands_sdf/2bfc_tzd.sdf
    4361 2020-05-08 17:41 test/pdb_ligands_sdf/2y6d_tqj.sdf
    3674 2020-05-08 17:41 test/pdb_ligands_sdf/3m3z_3f5.sdf
    5363 2020-05-08 17:41 test/pdb_ligands_sdf/2fm0_m98.sdf
    1405 2020-05-08 17:41 test/pdb_ligands_sdf/1aeb_3mt.sdf
    5479 2020-05-08 17:41 test/pdb_ligands_sdf/4u79_3el.sdf
    2952 2020-05-08 17:41 test/pdb_ligands_sdf/3ouh_014.sdf
    4300 2020-05-08 17:41 test/pdb_ligands_sdf/4uee_la9.sdf
    3578 2020-05-08 17:41 test/pdb_ligands_sdf/5alf_oe1.sdf
    4237 2020-05-08 17:41 test/pdb_ligands_sdf/3ac2_kse.sdf
    3776 2020-05-08 17:41 test/pdb_ligands_sdf/1rs9_d7p.sdf
    5507 2020-05-08 17:41 test/pdb_ligands_sdf/1q9d_oi1.sdf
    4754 2020-05-08 17:41 test/pdb_ligands_sdf/3ux0_0dv.sdf
    4824 2020-05-08 17:41 test/pdb_ligands_sdf/1v40_o16.sdf
    3615 2020-05-08 17:41 test/pdb_ligands_sdf/4lga_a2o.sdf
    6810 2020-05-08 17:41 test/pdb_ligands_sdf/1x89_cm1.sdf
    3502 2020-05-08 17:41 test/pdb_ligands_sdf/2pfh_ldt.sdf
    1823 2020-05-08 17:41 test/pdb_ligands_sdf/5e9i_f60.sdf
    4337 2020-05-08 17:41 test/pdb_ligands_sdf/1ldc_fmn.sdf
    2455 2020-05-08 17:41 test/pdb_ligands_sdf/4k55_h6p.sdf
    4690 2020-05-08 17:41 test/pdb_ligands_sdf/5t7f_76c.sdf
    2801 2020-05-08 17:41 test/pdb_ligands_sdf/3w3j_c09.sdf
    4104 2020-05-08 17:41 test/pdb_ligands_sdf/3d5q_t30.sdf
    4001 2020-05-08 17:41 test/pdb_ligands_sdf/1tkd_d3t.sdf
    3034 2020-05-08 17:41 test/pdb_ligands_sdf/1w1y_typ.sdf
    1371 2020-05-08 17:41 test/pdb_ligands_sdf/2dua_oxl.sdf
    1783 2020-05-08 17:41 test/pdb_ligands_sdf/4ews_pge.sdf
    3444 2020-05-08 17:41 test/pdb_ligands_sdf/5k0j_6p2.sdf
    3053 2020-05-08 17:41 test/pdb_ligands_sdf/3fed_bix.sdf
    5551 2020-05-08 17:41 test/pdb_ligands_sdf/4lwu_20u.sdf
    4943 2020-05-08 17:41 test/pdb_ligands_sdf/3h0q_b37.sdf
    3707 2020-05-08 17:41 test/pdb_ligands_sdf/1odn_apv.sdf
    4249 2020-05-08 17:41 test/pdb_ligands_sdf/5i09_1ud.sdf
    4660 2020-05-08 17:41 test/pdb_ligands_sdf/5jjr_68e.sdf
    3990 2020-05-08 17:41 test/pdb_ligands_sdf/5ctc_57k.sdf
    3924 2020-05-08 17:41 test/pdb_ligands_sdf/1w2d_4ip.sdf
    4363 2020-05-08 17:41 test/pdb_ligands_sdf/5jcu_gvx.sdf
    1468 2020-05-08 17:41 test/pdb_ligands_sdf/4ypd_dkg.sdf
    2420 2020-05-08 17:41 test/pdb_ligands_sdf/1o4r_787.sdf
    3245 2020-05-08 17:41 test/pdb_ligands_sdf/3vhk_bpk.sdf
    4639 2020-05-08 17:41 test/pdb_ligands_sdf/4f1s_f1s.sdf
    2489 2020-05-08 17:41 test/pdb_ligands_sdf/5j25_47k.sdf
    2215 2020-05-08 17:41 test/pdb_ligands_sdf/3dnd_ll2.sdf
    3976 2020-05-08 17:41 test/pdb_ligands_sdf/2ax7_fhm.sdf
    4066 2020-05-08 17:41 test/pdb_ligands_sdf/4b7d_qle.sdf
    6915 2020-05-08 17:41 test/pdb_ligands_sdf/3zn0_fad.sdf
    2027 2020-05-08 17:41 test/pdb_ligands_sdf/2alw_mnm.sdf
    2202 2020-05-08 17:41 test/pdb_ligands_sdf/4iyg_1hu.sdf
    4108 2020-05-08 17:41 test/pdb_ligands_sdf/4kkx_aq3.sdf
    4694 2020-05-08 17:41 test/pdb_ligands_sdf/1jjc_fa5.sdf
    2690 2020-05-08 17:41 test/pdb_ligands_sdf/5dri_5eq.sdf
    1336 2020-05-08 17:41 test/pdb_ligands_sdf/5d5a_bu1.sdf
    4129 2020-05-08 17:41 test/pdb_ligands_sdf/4jlm_1nn.sdf
    2529 2020-05-08 17:41 test/pdb_ligands_sdf/2o2c_g6q.sdf
    2720 2020-05-08 17:41 test/pdb_ligands_sdf/4bdj_z2m.sdf
    4589 2020-05-08 17:41 test/pdb_ligands_sdf/5axp_4lk.sdf
    2948 2020-05-08 17:41 test/pdb_ligands_sdf/4bwm_doc.sdf
    3791 2020-05-08 17:41 test/pdb_ligands_sdf/5dd9_59k.sdf
    3620 2020-05-08 17:41 test/pdb_ligands_sdf/3nxv_d2f.sdf
    1494 2020-05-08 17:41 test/pdb_ligands_sdf/3rda_mio.sdf
    3060 2020-05-08 17:41 test/pdb_ligands_sdf/5ivv_6en.sdf
    2397 2020-05-08 17:41 test/pdb_ligands_sdf/3utd_0cj.sdf
    6895 2020-05-08 17:41 test/pdb_ligands_sdf/4gql_r47.sdf
    3871 2020-05-08 17:41 test/pdb_ligands_sdf/2bvr_4cp.sdf
    3735 2020-05-08 17:41 test/pdb_ligands_sdf/4cfv_75x.sdf
    5844 2020-05-08 17:41 test/pdb_ligands_sdf/1q6j_335.sdf
    4317 2020-05-08 17:41 test/pdb_ligands_sdf/3dy6_dy6.sdf
    1590 2020-05-08 17:41 test/pdb_ligands_sdf/1ep9_cp.sdf
    3729 2020-05-08 17:41 test/pdb_ligands_sdf/4jub_tpp.sdf
    1343 2020-05-08 17:41 test/pdb_ligands_sdf/4ml4_pye.sdf
    1824 2020-05-08 17:41 test/pdb_ligands_sdf/3fjz_gpf.sdf
    5152 2020-05-08 17:41 test/pdb_ligands_sdf/5ls6_74d.sdf
    4024 2020-05-08 17:41 test/pdb_ligands_sdf/4cjk_h39.sdf
    5679 2020-05-08 17:41 test/pdb_ligands_sdf/4r4i_3hv.sdf
    3725 2020-05-08 17:41 test/pdb_ligands_sdf/2wou_zzf.sdf
    4870 2020-05-08 17:41 test/pdb_ligands_sdf/4k9y_k9y.sdf
    1930 2020-05-08 17:41 test/pdb_ligands_sdf/1dqa_mah.sdf
    5016 2020-05-08 17:41 test/pdb_ligands_sdf/2c1z_u2f.sdf
    2376 2020-05-08 17:41 test/pdb_ligands_sdf/2f92_ahd.sdf
    2311 2020-05-08 17:41 test/pdb_ligands_sdf/5vdv_9bv.sdf
    1929 2020-05-08 17:41 test/pdb_ligands_sdf/3cmp_dbh.sdf
    4071 2020-05-08 17:41 test/pdb_ligands_sdf/1xka_4pp.sdf
    2686 2020-05-08 17:41 test/pdb_ligands_sdf/4ng6_ris.sdf
    1988 2020-05-08 17:41 test/pdb_ligands_sdf/2iqd_lpa.sdf
    5356 2020-05-08 17:41 test/pdb_ligands_sdf/4pni_kqq.sdf
    9984 2020-05-08 17:41 test/pdb_ligands_sdf/5jwm_6on.sdf
    6418 2020-05-08 17:41 test/pdb_ligands_sdf/2gv7_672.sdf
    3478 2020-05-08 17:41 test/pdb_ligands_sdf/2z4b_dc8.sdf
    5173 2020-05-08 17:41 test/pdb_ligands_sdf/3gyn_b42.sdf
    3524 2020-05-08 17:41 test/pdb_ligands_sdf/3d6y_ber.sdf
    3820 2020-05-08 17:41 test/pdb_ligands_sdf/1yvx_ipc.sdf
    1947 2020-05-08 17:41 test/pdb_ligands_sdf/2wzd_3pg.sdf
    4346 2020-05-08 17:41 test/pdb_ligands_sdf/5tex_7au.sdf
    5164 2020-05-08 17:41 test/pdb_ligands_sdf/2jkm_bii.sdf
    2472 2020-05-08 17:41 test/pdb_ligands_sdf/1gzm_lda.sdf
    4692 2020-05-08 17:41 test/pdb_ligands_sdf/5ufr_88j.sdf
    4540 2020-05-08 17:41 test/pdb_ligands_sdf/5p8y_763.sdf
    2800 2020-05-08 17:41 test/pdb_ligands_sdf/2h3w_hc5.sdf
    3840 2020-05-08 17:41 test/pdb_ligands_sdf/2qs1_ub1.sdf
    4162 2020-05-08 17:41 test/pdb_ligands_sdf/4rj5_3qy.sdf
    1907 2020-05-08 17:41 test/pdb_ligands_sdf/1c23_mph.sdf
    3111 2020-05-08 17:41 test/pdb_ligands_sdf/4ja1_ngh.sdf
    3961 2020-05-08 17:41 test/pdb_ligands_sdf/5tri_7hm.sdf
    3113 2020-05-08 17:41 test/pdb_ligands_sdf/5aqw_5p7.sdf
    2552 2020-05-08 17:41 test/pdb_ligands_sdf/1q54_bhi.sdf
    6034 2020-05-08 17:41 test/pdb_ligands_sdf/5nn8_acr.sdf
    1836 2020-05-08 17:41 test/pdb_ligands_sdf/3slh_gpj.sdf
    1842 2020-05-08 17:41 test/pdb_ligands_sdf/1r31_mev.sdf
    4418 2020-05-08 17:41 test/pdb_ligands_sdf/2ozr_gg1.sdf
    4409 2020-05-08 17:41 test/pdb_ligands_sdf/5x5q_d16.sdf
    3614 2020-05-08 17:41 test/pdb_ligands_sdf/3t0l_1ct.sdf
    4043 2020-05-08 17:41 test/pdb_ligands_sdf/3pp1_izg.sdf
    3592 2020-05-08 17:41 test/pdb_ligands_sdf/5e29_rq3.sdf
    3427 2020-05-08 17:41 test/pdb_ligands_sdf/4hv7_19j.sdf
    4129 2020-05-08 17:41 test/pdb_ligands_sdf/2p7t_1em.sdf
    3965 2020-05-08 17:41 test/pdb_ligands_sdf/4wi1_3o6.sdf
    1729 2020-05-08 17:41 test/pdb_ligands_sdf/4jni_pzh.sdf
    7292 2020-05-08 17:41 test/pdb_ligands_sdf/4lhu_jls.sdf
    3537 2020-05-08 17:41 test/pdb_ligands_sdf/1a97_5gp.sdf
    2533 2020-05-08 17:41 test/pdb_ligands_sdf/3ecn_ibm.sdf
    4015 2020-05-08 17:41 test/pdb_ligands_sdf/4fz6_0vg.sdf
    2686 2020-05-08 17:41 test/pdb_ligands_sdf/4h42_11e.sdf
    3293 2020-05-08 17:41 test/pdb_ligands_sdf/3fue_bes.sdf
    4058 2020-05-08 17:41 test/pdb_ligands_sdf/4q8e_0kx.sdf
    3760 2020-05-08 17:41 test/pdb_ligands_sdf/3zrb_orc.sdf
    3881 2020-05-08 17:41 test/pdb_ligands_sdf/3zdu_38r.sdf
    2807 2020-05-08 17:41 test/pdb_ligands_sdf/1y2c_3de.sdf
    2695 2020-05-08 17:41 test/pdb_ligands_sdf/2xud_dme.sdf
    2534 2020-05-08 17:41 test/pdb_ligands_sdf/1yyt_saz.sdf
    4720 2020-05-08 17:41 test/pdb_ligands_sdf/1tvv_cb3.sdf
    3837 2020-05-08 17:41 test/pdb_ligands_sdf/4qjw_wwo.sdf
    4545 2020-05-08 17:41 test/pdb_ligands_sdf/4mh0_hr4.sdf
    3125 2020-05-08 17:41 test/pdb_ligands_sdf/5adm_9m9.sdf
    3795 2020-05-08 17:41 test/pdb_ligands_sdf/2ji9_tpw.sdf
    4149 2020-05-08 17:41 test/pdb_ligands_sdf/5lp6_71p.sdf
    4533 2020-05-08 17:41 test/pdb_ligands_sdf/4bfz_zvz.sdf
    4061 2020-05-08 17:41 test/pdb_ligands_sdf/3eoc_t2a.sdf
    6512 2020-05-08 17:41 test/pdb_ligands_sdf/2npf_mou.sdf
    4248 2020-05-08 17:41 test/pdb_ligands_sdf/1j78_vdy.sdf
    5055 2020-05-08 17:41 test/pdb_ligands_sdf/3m08_rar.sdf
    4323 2020-05-08 17:41 test/pdb_ligands_sdf/4og8_2sf.sdf
    4707 2020-05-08 17:41 test/pdb_ligands_sdf/2jjk_r15.sdf
    2595 2020-05-08 17:41 test/pdb_ligands_sdf/5wy9_1pg.sdf
    3385 2020-05-08 17:41 test/pdb_ligands_sdf/5hmy_lny.sdf
    4977 2020-05-08 17:41 test/pdb_ligands_sdf/4ihf_1f7.sdf
    5294 2020-05-08 17:41 test/pdb_ligands_sdf/4ksq_1sw.sdf
    1719 2020-05-08 17:41 test/pdb_ligands_sdf/4uu8_woc.sdf
    4420 2020-05-08 17:41 test/pdb_ligands_sdf/4mro_mg0.sdf
    4298 2020-05-08 17:41 test/pdb_ligands_sdf/2ofv_242.sdf
    3804 2020-05-08 17:41 test/pdb_ligands_sdf/3vhv_ld1.sdf
    5643 2020-05-08 17:41 test/pdb_ligands_sdf/4hyt_obn.sdf
    2528 2020-05-08 17:41 test/pdb_ligands_sdf/3r7l_pal.sdf
    5097 2020-05-08 17:41 test/pdb_ligands_sdf/5wqi_7x0.sdf
    5599 2020-05-08 17:41 test/pdb_ligands_sdf/3e2m_e2m.sdf
    1401 2020-05-08 17:41 test/pdb_ligands_sdf/5e9k_5kx.sdf
    2958 2020-05-08 17:41 test/pdb_ligands_sdf/2c2w_5cd.sdf
    4311 2020-05-08 17:41 test/pdb_ligands_sdf/2gd8_po1.sdf
    3293 2020-05-08 17:41 test/pdb_ligands_sdf/2iws_np4.sdf
    3182 2020-05-08 17:41 test/pdb_ligands_sdf/5ha7_wy1.sdf
    3816 2020-05-08 17:41 test/pdb_ligands_sdf/5ekn_n58.sdf
    4135 2020-05-08 17:41 test/pdb_ligands_sdf/4rj8_3qs.sdf
    3712 2020-05-08 17:41 test/pdb_ligands_sdf/4jr5_1ls.sdf
    3059 2020-05-08 17:41 test/pdb_ligands_sdf/5etm_5rw.sdf
    1938 2020-05-08 17:41 test/pdb_ligands_sdf/4tsq_pc.sdf
    1965 2020-05-08 17:41 test/pdb_ligands_sdf/1pl9_fpe.sdf
    4374 2020-05-08 17:41 test/pdb_ligands_sdf/3v0m_5gw.sdf
    5417 2020-05-08 17:41 test/pdb_ligands_sdf/5maf_xin.sdf
    3040 2020-05-08 17:41 test/pdb_ligands_sdf/1ljr_gsh.sdf
    3100 2020-05-08 17:41 test/pdb_ligands_sdf/4dae_6cr.sdf
    4880 2020-05-08 17:41 test/pdb_ligands_sdf/5b2x_w0t.sdf
    3891 2020-05-08 17:41 test/pdb_ligands_sdf/4yhj_an2.sdf
    4577 2020-05-08 17:41 test/pdb_ligands_sdf/3nw6_lgw.sdf
    4661 2020-05-08 17:41 test/pdb_ligands_sdf/4h1j_0yh.sdf
    2327 2020-05-08 17:41 test/pdb_ligands_sdf/3teh_dah.sdf
    3390 2020-05-08 17:41 test/pdb_ligands_sdf/5eag_5lu.sdf
    3416 2020-05-08 17:41 test/pdb_ligands_sdf/4cq8_jbw.sdf
    3489 2020-05-08 17:41 test/pdb_ligands_sdf/5en4_5q6.sdf
    4612 2020-05-08 17:41 test/pdb_ligands_sdf/4gxs_0ys.sdf
    4497 2020-05-08 17:41 test/pdb_ligands_sdf/2pj6_059.sdf
    1459 2020-05-08 17:41 test/pdb_ligands_sdf/3g4w_8cl.sdf
    4033 2020-05-08 17:41 test/pdb_ligands_sdf/4y5h_519.sdf
    3310 2020-05-08 17:41 test/pdb_ligands_sdf/5cgq_f9f.sdf
    2780 2020-05-08 17:41 test/pdb_ligands_sdf/6end_bgk.sdf
    3756 2020-05-08 17:41 test/pdb_ligands_sdf/1xmu_rof.sdf
    5239 2020-05-08 17:41 test/pdb_ligands_sdf/4qgg_32c.sdf
    3030 2020-05-08 17:41 test/pdb_ligands_sdf/1ydr_iqp.sdf
    1947 2020-05-08 17:41 test/pdb_ligands_sdf/7enl_2pg.sdf
    4233 2020-05-08 17:41 test/pdb_ligands_sdf/4rpv_3ur.sdf
    3991 2020-05-08 17:41 test/pdb_ligands_sdf/5n49_8lw.sdf
    3124 2020-05-08 17:41 test/pdb_ligands_sdf/4f9c_0sx.sdf
    3675 2020-05-08 17:41 test/pdb_ligands_sdf/1ndv_fr0.sdf
    3766 2020-05-08 17:41 test/pdb_ligands_sdf/2g8r_n3e.sdf
    2523 2020-05-08 17:41 test/pdb_ligands_sdf/1lkd_bp6.sdf
    5021 2020-05-08 17:41 test/pdb_ligands_sdf/2i4g_ua1.sdf
    2561 2020-05-08 17:41 test/pdb_ligands_sdf/3f19_hs6.sdf
    4899 2020-05-08 17:41 test/pdb_ligands_sdf/5ut4_dqx.sdf
    3162 2020-05-08 17:41 test/pdb_ligands_sdf/3oaw_oaw.sdf
    4079 2020-05-08 17:41 test/pdb_ligands_sdf/4oex_5eo.sdf
    2822 2020-05-08 17:41 test/pdb_ligands_sdf/5ox5_b2e.sdf
    3912 2020-05-08 17:41 test/pdb_ligands_sdf/1ix1_bb2.sdf
    2782 2020-05-08 17:41 test/pdb_ligands_sdf/1xai_crb.sdf
    3707 2020-05-08 17:41 test/pdb_ligands_sdf/3g58_988.sdf
    7237 2020-05-08 17:41 test/pdb_ligands_sdf/5mes_7lt.sdf
    3402 2020-05-08 17:41 test/pdb_ligands_sdf/3u5l_08k.sdf
    2285 2020-05-08 17:41 test/pdb_ligands_sdf/1zpl_mag.sdf
    3588 2020-05-08 17:41 test/pdb_ligands_sdf/2p55_mra.sdf
    2171 2020-05-08 17:41 test/pdb_ligands_sdf/3aki_ah8.sdf
    4419 2020-05-08 17:41 test/pdb_ligands_sdf/4wn1_3sj.sdf
    3289 2020-05-08 17:41 test/pdb_ligands_sdf/4mns_2ax.sdf
    6131 2020-05-08 17:41 test/pdb_ligands_sdf/4jdd_fsc.sdf
    4995 2020-05-08 17:41 test/pdb_ligands_sdf/5jcb_nv4.sdf
    1687 2020-05-08 17:41 test/pdb_ligands_sdf/1l4k_34a.sdf
    1574 2020-05-08 17:41 test/pdb_ligands_sdf/4hgf_syn.sdf
    1923 2020-05-08 17:41 test/pdb_ligands_sdf/1hu9_4hm.sdf
    4201 2020-05-08 17:41 test/pdb_ligands_sdf/5c25_639.sdf
    5483 2020-05-08 17:41 test/pdb_ligands_sdf/3qri_919.sdf
    7515 2020-05-08 17:41 test/pdb_ligands_sdf/1qz6_jas.sdf
    5157 2020-05-08 17:41 test/pdb_ligands_sdf/5p9n_7je.sdf
    2492 2020-05-08 17:41 test/pdb_ligands_sdf/5eci_jaa.sdf
    4196 2020-05-08 17:41 test/pdb_ligands_sdf/5h7o_7q7.sdf
    2676 2020-05-08 17:41 test/pdb_ligands_sdf/3nun_jmz.sdf
    6446 2020-05-08 17:41 test/pdb_ligands_sdf/3e16_b4c.sdf
    3480 2020-05-08 17:41 test/pdb_ligands_sdf/2h8m_nei.sdf
    3292 2020-05-08 17:41 test/pdb_ligands_sdf/5ht5_65h.sdf
    3222 2020-05-08 17:41 test/pdb_ligands_sdf/1dil_eqp.sdf
    3959 2020-05-08 17:41 test/pdb_ligands_sdf/3dgr_a12.sdf
    6552 2020-05-08 17:41 test/pdb_ligands_sdf/4x3o_3y0.sdf
    3584 2020-05-08 17:41 test/pdb_ligands_sdf/2vlh_pm9.sdf
    3447 2020-05-08 17:41 test/pdb_ligands_sdf/1n2b_apc.sdf
    6692 2020-05-08 17:41 test/pdb_ligands_sdf/1x8u_cm2.sdf
    3194 2020-05-08 17:41 test/pdb_ligands_sdf/5kzd_rcj.sdf
    4522 2020-05-08 17:41 test/pdb_ligands_sdf/3v0n_4gw.sdf
    3064 2020-05-08 17:41 test/pdb_ligands_sdf/4ij9_ptv.sdf
    4127 2020-05-08 17:41 test/pdb_ligands_sdf/4a81_dxc.sdf
    1603 2020-05-08 17:41 test/pdb_ligands_sdf/1at1_pct.sdf
    4213 2020-05-08 17:41 test/pdb_ligands_sdf/4h96_14q.sdf
    3287 2020-05-08 17:41 test/pdb_ligands_sdf/3klp_b81.sdf
    3482 2020-05-08 17:41 test/pdb_ligands_sdf/4cqa_id6.sdf
    4716 2020-05-08 17:41 test/pdb_ligands_sdf/5vd1_p48.sdf
    2606 2020-05-08 17:41 test/pdb_ligands_sdf/4zea_imi.sdf
    4021 2020-05-08 17:41 test/pdb_ligands_sdf/5cal_4z8.sdf
    1922 2020-05-08 17:41 test/pdb_ligands_sdf/3qxx_8ac.sdf
    2686 2020-05-08 17:41 test/pdb_ligands_sdf/1e92_hbi.sdf
    3517 2020-05-08 17:41 test/pdb_ligands_sdf/1bk0_acv.sdf
    3413 2020-05-08 17:41 test/pdb_ligands_sdf/3e33_fpp.sdf
    4502 2020-05-08 17:41 test/pdb_ligands_sdf/3ghc_ghc.sdf
    4119 2020-05-08 17:41 test/pdb_ligands_sdf/4i4f_1br.sdf
    3806 2020-05-08 17:41 test/pdb_ligands_sdf/1uyi_puz.sdf
    3519 2020-05-08 17:41 test/pdb_ligands_sdf/5ugs_xt5.sdf
    4862 2020-05-08 17:41 test/pdb_ligands_sdf/5lyl_t5f.sdf
    4641 2020-05-08 17:41 test/pdb_ligands_sdf/4xkx_43k.sdf
    3867 2020-05-08 17:41 test/pdb_ligands_sdf/4mf3_sxi.sdf
    3245 2020-05-08 17:41 test/pdb_ligands_sdf/5g69_m7k.sdf
    2566 2020-05-08 17:41 test/pdb_ligands_sdf/4lw1_1xs.sdf
    3097 2020-05-08 17:41 test/pdb_ligands_sdf/6eks_g39.sdf
    1310 2020-05-08 17:41 test/pdb_ligands_sdf/3tzv_hex.sdf
    3776 2020-05-08 17:41 test/pdb_ligands_sdf/5lxc_7aa.sdf
    4113 2020-05-08 17:41 test/pdb_ligands_sdf/1d1b_daq.sdf
    3675 2020-05-08 17:41 test/pdb_ligands_sdf/3pa5_c73.sdf
    3798 2020-05-08 17:41 test/pdb_ligands_sdf/3zcv_n85.sdf
    2563 2020-05-08 17:41 test/pdb_ligands_sdf/5f6d_5vj.sdf
    3652 2020-05-08 17:41 test/pdb_ligands_sdf/3mqf_20x.sdf
    3835 2020-05-08 17:41 test/pdb_ligands_sdf/4c3a_q16.sdf
    4082 2020-05-08 17:41 test/pdb_ligands_sdf/3v0q_bhe.sdf
    4332 2020-05-08 17:41 test/pdb_ligands_sdf/2chw_039.sdf
    3412 2020-05-08 17:41 test/pdb_ligands_sdf/4q4p_2yo.sdf
    4141 2020-05-08 17:41 test/pdb_ligands_sdf/1w19_t4p.sdf
    3668 2020-05-08 17:41 test/pdb_ligands_sdf/2x7f_824.sdf
    2411 2020-05-08 17:41 test/pdb_ligands_sdf/2aow_tha.sdf
    4017 2020-05-08 17:41 test/pdb_ligands_sdf/3ki7_g9i.sdf
    5664 2020-05-08 17:41 test/pdb_ligands_sdf/5kjm_6tm.sdf
    4020 2020-05-08 17:41 test/pdb_ligands_sdf/3ue8_09m.sdf
    3268 2020-05-08 17:41 test/pdb_ligands_sdf/1fsg_prp.sdf
    3861 2020-05-08 17:41 test/pdb_ligands_sdf/5bml_4tw.sdf
    3374 2020-05-08 17:41 test/pdb_ligands_sdf/4uba_3g5.sdf
    2349 2020-05-08 17:41 test/pdb_ligands_sdf/1tgy_r1p.sdf
    4178 2020-05-08 17:41 test/pdb_ligands_sdf/5dog_5dt.sdf
    4008 2020-05-08 17:41 test/pdb_ligands_sdf/4cjp_4d2.sdf
    4443 2020-05-08 17:41 test/pdb_ligands_sdf/5jfw_6k2.sdf
    4422 2020-05-08 17:41 test/pdb_ligands_sdf/3ua9_iwr.sdf
    2845 2020-05-08 17:41 test/pdb_ligands_sdf/5fi9_nt8.sdf
    3277 2020-05-08 17:41 test/pdb_ligands_sdf/3uzx_aom.sdf
    3643 2020-05-08 17:41 test/pdb_ligands_sdf/5ivf_6eb.sdf
    2329 2020-05-08 17:41 test/pdb_ligands_sdf/4ept_0qw.sdf
    5012 2020-05-08 17:41 test/pdb_ligands_sdf/5p94_76t.sdf
    2189 2020-05-08 17:41 test/pdb_ligands_sdf/4xnb_3fb.sdf
    2618 2020-05-08 17:41 test/pdb_ligands_sdf/4c70_tlj.sdf
    6485 2020-05-08 17:41 test/pdb_ligands_sdf/3ssn_mvi.sdf
    2402 2020-05-08 17:41 test/pdb_ligands_sdf/5csh_54e.sdf
    4512 2020-05-08 17:41 test/pdb_ligands_sdf/5vp0_9gj.sdf
    2917 2020-05-08 17:41 test/pdb_ligands_sdf/3pgi_f41.sdf
    1342 2020-05-08 17:41 test/pdb_ligands_sdf/4ywb_oxd.sdf
    4455 2020-05-08 17:41 test/pdb_ligands_sdf/1wci_wwf.sdf
    4837 2020-05-08 17:41 test/pdb_ligands_sdf/5p8x_75z.sdf
    4541 2020-05-08 17:41 test/pdb_ligands_sdf/4l53_1uo.sdf
    4636 2020-05-08 17:41 test/pdb_ligands_sdf/3r8a_hig.sdf
    5100 2020-05-08 17:41 test/pdb_ligands_sdf/3efk_mt4.sdf
    5182 2020-05-08 17:41 test/pdb_ligands_sdf/3b1m_krc.sdf
    6667 2020-05-08 17:41 test/pdb_ligands_sdf/4wt2_3ud.sdf
    4436 2020-05-08 17:41 test/pdb_ligands_sdf/5ap4_o38.sdf
    4580 2020-05-08 17:41 test/pdb_ligands_sdf/4b7p_9un.sdf
    3575 2020-05-08 17:41 test/pdb_ligands_sdf/3f8z_dh1.sdf
    2916 2020-05-08 17:41 test/pdb_ligands_sdf/3v1v_gst.sdf
    4382 2020-05-08 17:41 test/pdb_ligands_sdf/3t19_5ma.sdf
    4668 2020-05-08 17:41 test/pdb_ligands_sdf/3qlf_pd5.sdf
    3501 2020-05-08 17:41 test/pdb_ligands_sdf/5dwi_5g3.sdf
    2775 2020-05-08 17:41 test/pdb_ligands_sdf/2veg_pmm.sdf
    5391 2020-05-08 17:41 test/pdb_ligands_sdf/3h5s_h5s.sdf
    3786 2020-05-08 17:41 test/pdb_ligands_sdf/6ezq_c7k.sdf
    5676 2020-05-08 17:41 test/pdb_ligands_sdf/5exn_5su.sdf
    5407 2020-05-08 17:41 test/pdb_ligands_sdf/4qoc_35t.sdf
    3249 2020-05-08 17:41 test/pdb_ligands_sdf/3nbk_pns.sdf
    2299 2020-05-08 17:41 test/pdb_ligands_sdf/2vvp_r52.sdf
    4886 2020-05-08 17:41 test/pdb_ligands_sdf/1o5m_336.sdf
    2777 2020-05-08 17:41 test/pdb_ligands_sdf/2vuk_p83.sdf
    2701 2020-05-08 17:41 test/pdb_ligands_sdf/2aov_c2m.sdf
    4393 2020-05-08 17:41 test/pdb_ligands_sdf/4tx0_384.sdf
    6184 2020-05-08 17:41 test/pdb_ligands_sdf/5qbw_b8s.sdf
    3265 2020-05-08 17:41 test/pdb_ligands_sdf/5myt_zqc.sdf
    4841 2020-05-08 17:41 test/pdb_ligands_sdf/4hlc_t05.sdf
    4497 2020-05-08 17:41 test/pdb_ligands_sdf/3kkm_gnp.sdf
    3291 2020-05-08 17:41 test/pdb_ligands_sdf/4ugy_exi.sdf
    2458 2020-05-08 17:41 test/pdb_ligands_sdf/5h1t_7ff.sdf
    4347 2020-05-08 17:41 test/pdb_ligands_sdf/1s9i_5ea.sdf
    6340 2020-05-08 17:41 test/pdb_ligands_sdf/4lxd_1xv.sdf
    2156 2020-05-08 17:41 test/pdb_ligands_sdf/3uv3_0cm.sdf
    4219 2020-05-08 17:41 test/pdb_ligands_sdf/3mfh_dtp.sdf
    3682 2020-05-08 17:41 test/pdb_ligands_sdf/3sm0_aek.sdf
    5856 2020-05-08 17:41 test/pdb_ligands_sdf/3rba_cod.sdf
    2460 2020-05-08 17:41 test/pdb_ligands_sdf/4kza_nz9.sdf
    4288 2020-05-08 17:41 test/pdb_ligands_sdf/4nyx_2o4.sdf
    4667 2020-05-08 17:41 test/pdb_ligands_sdf/4ac0_miy.sdf
    4147 2020-05-08 17:41 test/pdb_ligands_sdf/5g4c_cna.sdf
    2221 2020-05-08 17:41 test/pdb_ligands_sdf/5g42_4tu.sdf
    3708 2020-05-08 17:41 test/pdb_ligands_sdf/1bnm_al8.sdf
    3429 2020-05-08 17:41 test/pdb_ligands_sdf/1yqy_915.sdf
    4180 2020-05-08 17:41 test/pdb_ligands_sdf/3sml_fw1.sdf
    2583 2020-05-08 17:41 test/pdb_ligands_sdf/2wf8_g1p.sdf
    3903 2020-05-08 17:41 test/pdb_ligands_sdf/5kcx_6s3.sdf
    3920 2020-05-08 17:41 test/pdb_ligands_sdf/5tld_6wv.sdf
    4546 2020-05-08 17:41 test/pdb_ligands_sdf/3lco_lc0.sdf
    3059 2020-05-08 17:41 test/pdb_ligands_sdf/6esy_tfx.sdf
    5107 2020-05-08 17:41 test/pdb_ligands_sdf/5vew_97y.sdf
    8785 2020-05-08 17:41 test/pdb_ligands_sdf/1xh0_aao.sdf
    5918 2020-05-08 17:41 test/pdb_ligands_sdf/1yow_p0e.sdf
    3052 2020-05-08 17:41 test/pdb_ligands_sdf/5hbm_nvp.sdf
    4199 2020-05-08 17:41 test/pdb_ligands_sdf/2x38_ic8.sdf
    2337 2020-05-08 17:41 test/pdb_ligands_sdf/3zdh_xrs.sdf
    5136 2020-05-08 17:41 test/pdb_ligands_sdf/2q59_240.sdf
    2906 2020-05-08 17:41 test/pdb_ligands_sdf/4yu2_4h5.sdf
    3280 2020-05-08 17:41 test/pdb_ligands_sdf/3fp0_fp0.sdf
    2445 2020-05-08 17:41 test/pdb_ligands_sdf/4h4c_10d.sdf
    4960 2020-05-08 17:41 test/pdb_ligands_sdf/4p45_2f9.sdf
    1353 2020-05-08 17:41 test/pdb_ligands_sdf/1ojr_2ha.sdf
    3504 2020-05-08 17:41 test/pdb_ligands_sdf/3ocw_3am.sdf
    2070 2020-05-08 17:41 test/pdb_ligands_sdf/4n97_2hu.sdf
    1784 2020-05-08 17:41 test/pdb_ligands_sdf/3nq9_oca.sdf
    3716 2020-05-08 17:41 test/pdb_ligands_sdf/5kzq_6ys.sdf
    4805 2020-05-08 17:41 test/pdb_ligands_sdf/4c0w_12p.sdf
    2089 2020-05-08 17:41 test/pdb_ligands_sdf/5g4q_2hq.sdf
    3231 2020-05-08 17:41 test/pdb_ligands_sdf/2ewb_zed.sdf
    3849 2020-05-08 17:41 test/pdb_ligands_sdf/4mh7_mh7.sdf
    2569 2020-05-08 17:41 test/pdb_ligands_sdf/4az7_log.sdf
    4382 2020-05-08 17:41 test/pdb_ligands_sdf/2pj2_864.sdf
    4232 2020-05-08 17:41 test/pdb_ligands_sdf/3cyl_vit.sdf
    3976 2020-05-08 17:41 test/pdb_ligands_sdf/6b16_c7y.sdf
    3125 2020-05-08 17:41 test/pdb_ligands_sdf/3dcv_55e.sdf
    5007 2020-05-08 17:41 test/pdb_ligands_sdf/3vsx_r32.sdf
    6240 2020-05-08 17:41 test/pdb_ligands_sdf/1qvn_fri.sdf
    5311 2020-05-08 17:41 test/pdb_ligands_sdf/2jld_ag1.sdf
    2379 2020-05-08 17:41 test/pdb_ligands_sdf/4gvf_ndg.sdf
    4722 2020-05-08 17:41 test/pdb_ligands_sdf/3e8c_g96.sdf
    2898 2020-05-08 17:41 test/pdb_ligands_sdf/5wyx_cu8.sdf
    2025 2020-05-08 17:41 test/pdb_ligands_sdf/3h0f_pg5.sdf
    3870 2020-05-08 17:41 test/pdb_ligands_sdf/3qip_p4y.sdf
    4251 2020-05-08 17:41 test/pdb_ligands_sdf/1w29_ts0.sdf
    2580 2020-05-08 17:41 test/pdb_ligands_sdf/5k01_6ow.sdf
    4220 2020-05-08 17:41 test/pdb_ligands_sdf/2y5k_ycu.sdf
    3961 2020-05-08 17:41 test/pdb_ligands_sdf/1lx6_zam.sdf
    2189 2020-05-08 17:41 test/pdb_ligands_sdf/3usd_idl.sdf
    3777 2020-05-08 17:41 test/pdb_ligands_sdf/3ki6_g9l.sdf
    4509 2020-05-08 17:41 test/pdb_ligands_sdf/3frj_a49.sdf
    4571 2020-05-08 17:41 test/pdb_ligands_sdf/5ap3_au5.sdf
    3612 2020-05-08 17:41 test/pdb_ligands_sdf/4iph_1fj.sdf
    4170 2020-05-08 17:41 test/pdb_ligands_sdf/3lp2_lp9.sdf
    4841 2020-05-08 17:41 test/pdb_ligands_sdf/3ewj_642.sdf
    3834 2020-05-08 17:41 test/pdb_ligands_sdf/3s2v_3hu.sdf
    2027 2020-05-08 17:41 test/pdb_ligands_sdf/2z24_dor.sdf
    2239 2020-05-08 17:41 test/pdb_ligands_sdf/4xqg_1ps.sdf
    4989 2020-05-08 17:41 test/pdb_ligands_sdf/3wd4_a1l.sdf
    2328 2020-05-08 17:41 test/pdb_ligands_sdf/4p6c_res.sdf
    3624 2020-05-08 17:41 test/pdb_ligands_sdf/4lgh_0jn.sdf
    3579 2020-05-08 17:41 test/pdb_ligands_sdf/4ly1_20y.sdf
    2116 2020-05-08 17:41 test/pdb_ligands_sdf/4bgm_dlt.sdf
    2460 2020-05-08 17:41 test/pdb_ligands_sdf/4mrm_2by.sdf
    2065 2020-05-08 17:41 test/pdb_ligands_sdf/1aod_ins.sdf
    2892 2020-05-08 17:41 test/pdb_ligands_sdf/2g5v_22m.sdf
    4490 2020-05-08 17:41 test/pdb_ligands_sdf/3pjc_pjc.sdf
    2385 2020-05-08 17:41 test/pdb_ligands_sdf/4jih_epr.sdf
    3272 2020-05-08 17:41 test/pdb_ligands_sdf/3cuf_9mr.sdf
    2894 2020-05-08 17:41 test/pdb_ligands_sdf/3rlb_vib.sdf
    2454 2020-05-08 17:41 test/pdb_ligands_sdf/5xqx_8cc.sdf
    2281 2020-05-08 17:41 test/pdb_ligands_sdf/6axn_btm.sdf
    4477 2020-05-08 17:41 test/pdb_ligands_sdf/3dt7_gtp.sdf
    5144 2020-05-08 17:41 test/pdb_ligands_sdf/2zno_s44.sdf
    1991 2020-05-08 17:41 test/pdb_ligands_sdf/4m5n_yh7.sdf
    3906 2020-05-08 17:41 test/pdb_ligands_sdf/4wkp_3qa.sdf
    4038 2020-05-08 17:41 test/pdb_ligands_sdf/4lwt_20q.sdf
    3884 2020-05-08 17:41 test/pdb_ligands_sdf/3uan_a3p.sdf
    2656 2020-05-08 17:41 test/pdb_ligands_sdf/3ekd_pam.sdf
    3191 2020-05-08 17:41 test/pdb_ligands_sdf/4zu0_c5p.sdf
    4925 2020-05-08 17:41 test/pdb_ligands_sdf/3rvf_034.sdf
    3762 2020-05-08 17:41 test/pdb_ligands_sdf/2wuf_kem.sdf
    4853 2020-05-08 17:41 test/pdb_ligands_sdf/3cwj_321.sdf
    4160 2020-05-08 17:41 test/pdb_ligands_sdf/4wkh_cbs.sdf
    3830 2020-05-08 17:41 test/pdb_ligands_sdf/3uod_0c3.sdf
    2380 2020-05-08 17:41 test/pdb_ligands_sdf/1zly_grf.sdf
    4408 2020-05-08 17:41 test/pdb_ligands_sdf/3r91_06h.sdf
    4326 2020-05-08 17:41 test/pdb_ligands_sdf/2iei_frx.sdf
    3224 2020-05-08 17:41 test/pdb_ligands_sdf/3uzz_tes.sdf
    2575 2020-05-08 17:41 test/pdb_ligands_sdf/5huu_g6p.sdf
    3895 2020-05-08 17:41 test/pdb_ligands_sdf/5tcc_j56.sdf
    4351 2020-05-08 17:41 test/pdb_ligands_sdf/2zyu_pps.sdf
    2083 2020-05-08 17:41 test/pdb_ligands_sdf/4n0s_dhc.sdf
    4126 2020-05-08 17:41 test/pdb_ligands_sdf/4x4l_3xg.sdf
    4093 2020-05-08 17:41 test/pdb_ligands_sdf/1zyq_dad.sdf
    3274 2020-05-08 17:41 test/pdb_ligands_sdf/2q6m_p34.sdf
    7587 2020-05-08 17:41 test/pdb_ligands_sdf/1jk7_oka.sdf
    4522 2020-05-08 17:41 test/pdb_ligands_sdf/5mts_xka.sdf
    3349 2020-05-08 17:41 test/pdb_ligands_sdf/2h79_t3.sdf
    4014 2020-05-08 17:41 test/pdb_ligands_sdf/1n38_u3h.sdf
    2452 2020-05-08 17:41 test/pdb_ligands_sdf/4yqk_4gs.sdf
    4082 2020-05-08 17:41 test/pdb_ligands_sdf/4pnz_2vh.sdf
    6132 2020-05-08 17:41 test/pdb_ligands_sdf/3oag_lpq.sdf
    3846 2020-05-08 17:41 test/pdb_ligands_sdf/1uvt_i48.sdf
    2565 2020-05-08 17:41 test/pdb_ligands_sdf/2g70_hnt.sdf
    4736 2020-05-08 17:41 test/pdb_ligands_sdf/5isd_6cz.sdf
    3098 2020-05-08 17:41 test/pdb_ligands_sdf/5h2z_7gf.sdf
    4067 2020-05-08 17:41 test/pdb_ligands_sdf/2uwl_895.sdf
    3124 2020-05-08 17:41 test/pdb_ligands_sdf/1sff_ik2.sdf
    2447 2020-05-08 17:41 test/pdb_ligands_sdf/5ci9_549.sdf
    3101 2020-05-08 17:41 test/pdb_ligands_sdf/5uvz_8np.sdf
    3488 2020-05-08 17:41 test/pdb_ligands_sdf/5vuo_9os.sdf
    1702 2020-05-08 17:41 test/pdb_ligands_sdf/3e6i_lz1.sdf
    3019 2020-05-08 17:41 test/pdb_ligands_sdf/5axc_arj.sdf
    1842 2020-05-08 17:41 test/pdb_ligands_sdf/1b57_pgh.sdf
    6366 2020-05-08 17:41 test/pdb_ligands_sdf/3own_3ox.sdf
    1638 2020-05-08 17:41 test/pdb_ligands_sdf/3kqr_ope.sdf
    4306 2020-05-08 17:41 test/pdb_ligands_sdf/4lmn_eui.sdf
    4171 2020-05-08 17:41 test/pdb_ligands_sdf/4pgq_1fz.sdf
    3017 2020-05-08 17:41 test/pdb_ligands_sdf/3hrf_p47.sdf
    5266 2020-05-08 17:41 test/pdb_ligands_sdf/4c5d_x0r.sdf
    5911 2020-05-08 17:41 test/pdb_ligands_sdf/3lbj_ww8.sdf
    2665 2020-05-08 17:41 test/pdb_ligands_sdf/5aoj_y0v.sdf
    2321 2020-05-08 17:41 test/pdb_ligands_sdf/4kxw_dx5.sdf
    4676 2020-05-08 17:41 test/pdb_ligands_sdf/4c4i_x20.sdf
    3470 2020-05-08 17:41 test/pdb_ligands_sdf/1zfk_nr2.sdf
    3624 2020-05-08 17:41 test/pdb_ligands_sdf/4xm7_41s.sdf
    2904 2020-05-08 17:41 test/pdb_ligands_sdf/2nuv_2tn.sdf
    2586 2020-05-08 17:41 test/pdb_ligands_sdf/1lbx_ipd.sdf
    4776 2020-05-08 17:41 test/pdb_ligands_sdf/2itq_itq.sdf
    2435 2020-05-08 17:41 test/pdb_ligands_sdf/1p4f_drg.sdf
    1339 2020-05-08 17:41 test/pdb_ligands_sdf/1p0i_bua.sdf
    3485 2020-05-08 17:41 test/pdb_ligands_sdf/4oo9_2u8.sdf
    1473 2020-05-08 17:41 test/pdb_ligands_sdf/3zlu_1ka.sdf
    2227 2020-05-08 17:41 test/pdb_ligands_sdf/2e9c_b75.sdf
    2725 2020-05-08 17:41 test/pdb_ligands_sdf/3kw4_tic.sdf
    4592 2020-05-08 17:41 test/pdb_ligands_sdf/5v3o_8w7.sdf
    2675 2020-05-08 17:41 test/pdb_ligands_sdf/3mkn_dnb.sdf
    4679 2020-05-08 17:41 test/pdb_ligands_sdf/2o8h_227.sdf
    3375 2020-05-08 17:41 test/pdb_ligands_sdf/5kdf_6ru.sdf
    3257 2020-05-08 17:41 test/pdb_ligands_sdf/1kdk_dht.sdf
    4822 2020-05-08 17:41 test/pdb_ligands_sdf/4lch_1wn.sdf
    2249 2020-05-08 17:41 test/pdb_ligands_sdf/5bp0_fn1.sdf
    1898 2020-05-08 17:41 test/pdb_ligands_sdf/1xr3_isz.sdf
    2950 2020-05-08 17:41 test/pdb_ligands_sdf/4y6s_48s.sdf
    3378 2020-05-08 17:41 test/pdb_ligands_sdf/4q9z_pzw.sdf
    5405 2020-05-08 17:41 test/pdb_ligands_sdf/4fob_0us.sdf
    4992 2020-05-08 17:41 test/pdb_ligands_sdf/1y57_mpz.sdf
    3056 2020-05-08 17:41 test/pdb_ligands_sdf/4uw1_92r.sdf
    2194 2020-05-08 17:41 test/pdb_ligands_sdf/4hfn_ciy.sdf
    2401 2020-05-08 17:41 test/pdb_ligands_sdf/4ajh_2b4.sdf
    3027 2020-05-08 17:41 test/pdb_ligands_sdf/3r8h_zom.sdf
    2081 2020-05-08 17:41 test/pdb_ligands_sdf/5g43_5im.sdf
    3163 2020-05-08 17:41 test/pdb_ligands_sdf/5bzr_4xm.sdf
    4337 2020-05-08 17:41 test/pdb_ligands_sdf/2r0u_m54.sdf
    3904 2020-05-08 17:41 test/pdb_ligands_sdf/3mtl_fef.sdf
    3312 2020-05-08 17:41 test/pdb_ligands_sdf/3g1v_5fu.sdf
    2218 2020-05-08 17:41 test/pdb_ligands_sdf/3l5p_428.sdf
    4744 2020-05-08 17:41 test/pdb_ligands_sdf/2r9n_y14.sdf
    3029 2020-05-08 17:41 test/pdb_ligands_sdf/5e4t_mbt.sdf
    3921 2020-05-08 17:41 test/pdb_ligands_sdf/3p0g_p0g.sdf
    1506 2020-05-08 17:41 test/pdb_ligands_sdf/2e49_mh6.sdf
    5672 2020-05-08 17:41 test/pdb_ligands_sdf/4wxh_3vl.sdf
    1723 2020-05-08 17:41 test/pdb_ligands_sdf/3hjq_mbd.sdf
    3407 2020-05-08 17:41 test/pdb_ligands_sdf/2cgf_p2n.sdf
    2437 2020-05-08 17:41 test/pdb_ligands_sdf/2nn1_m28.sdf
    4091 2020-05-08 17:41 test/pdb_ligands_sdf/5enm_5qu.sdf
    4416 2020-05-08 17:41 test/pdb_ligands_sdf/4zyw_g94.sdf
    3653 2020-05-08 17:41 test/pdb_ligands_sdf/2qs4_ly5.sdf
    3775 2020-05-08 17:41 test/pdb_ligands_sdf/1uym_pu3.sdf
    3037 2020-05-08 17:41 test/pdb_ligands_sdf/2wxd_e18.sdf
    3096 2020-05-08 17:41 test/pdb_ligands_sdf/1c0t_bm1.sdf
    3308 2020-05-08 17:41 test/pdb_ligands_sdf/1l5l_7rp.sdf
    3126 2020-05-08 17:41 test/pdb_ligands_sdf/3h0v_m2t.sdf
    4269 2020-05-08 17:41 test/pdb_ligands_sdf/3g15_hc6.sdf
    4275 2020-05-08 17:41 test/pdb_ligands_sdf/2r9s_255.sdf
    3182 2020-05-08 17:41 test/pdb_ligands_sdf/3w76_w76.sdf
    3453 2020-05-08 17:41 test/pdb_ligands_sdf/2cy6_tre.sdf
    3976 2020-05-08 17:41 test/pdb_ligands_sdf/5tb8_1rz.sdf
    5186 2020-05-08 17:41 test/pdb_ligands_sdf/4i5m_r78.sdf
    3793 2020-05-08 17:41 test/pdb_ligands_sdf/2buc_008.sdf
    3433 2020-05-08 17:41 test/pdb_ligands_sdf/4qsj_eww.sdf
    3496 2020-05-08 17:41 test/pdb_ligands_sdf/5vv9_9og.sdf
    3155 2020-05-08 17:41 test/pdb_ligands_sdf/4d2w_nf5.sdf
    2887 2020-05-08 17:41 test/pdb_ligands_sdf/1tow_crz.sdf
    4889 2020-05-08 17:41 test/pdb_ligands_sdf/2o3t_cgr.sdf
    4356 2020-05-08 17:41 test/pdb_ligands_sdf/4lrh_fol.sdf
    4569 2020-05-08 17:41 test/pdb_ligands_sdf/4rn2_l7g.sdf
    3459 2020-05-08 17:41 test/pdb_ligands_sdf/2jaw_bvp.sdf
    5317 2020-05-08 17:41 test/pdb_ligands_sdf/5kup_6xl.sdf
    3528 2020-05-08 17:41 test/pdb_ligands_sdf/2fl6_n5t.sdf
    4773 2020-05-08 17:41 test/pdb_ligands_sdf/4d7f_ixa.sdf
    1737 2020-05-08 17:41 test/pdb_ligands_sdf/3ch9_xrg.sdf
    1639 2020-05-08 17:41 test/pdb_ligands_sdf/2g8x_dtt.sdf
    2035 2020-05-08 17:41 test/pdb_ligands_sdf/4zk6_ntm.sdf
    5258 2020-05-08 17:41 test/pdb_ligands_sdf/4ynk_yw2.sdf
    5803 2020-05-08 17:41 test/pdb_ligands_sdf/5wkg_d21.sdf
    3477 2020-05-08 17:41 test/pdb_ligands_sdf/3kkt_0cp.sdf
    3566 2020-05-08 17:41 test/pdb_ligands_sdf/2xvu_9dn.sdf
    5627 2020-05-08 17:41 test/pdb_ligands_sdf/5ivr_6eg.sdf
    2549 2020-05-08 17:41 test/pdb_ligands_sdf/3sqp_3j8.sdf
    5259 2020-05-08 17:41 test/pdb_ligands_sdf/5ntw_98n.sdf
    5037 2020-05-08 17:41 test/pdb_ligands_sdf/2bvs_2ce.sdf
    4376 2020-05-08 17:41 test/pdb_ligands_sdf/4rss_4mg.sdf
    2599 2020-05-08 17:41 test/pdb_ligands_sdf/2z6q_dcz.sdf
    4493 2020-05-08 17:41 test/pdb_ligands_sdf/5ksx_7am.sdf
    3174 2020-05-08 17:41 test/pdb_ligands_sdf/4oim_jus.sdf
    2315 2020-05-08 17:41 test/pdb_ligands_sdf/4nvh_2nb.sdf
    2752 2020-05-08 17:41 test/pdb_ligands_sdf/5cso_ctn.sdf
    5161 2020-05-08 17:41 test/pdb_ligands_sdf/2r4f_rie.sdf
    4007 2020-05-08 17:41 test/pdb_ligands_sdf/5vsq_a2v.sdf
    3543 2020-05-08 17:41 test/pdb_ligands_sdf/3b5b_ndn.sdf
    3372 2020-05-08 17:41 test/pdb_ligands_sdf/4u2y_rzm.sdf
    3015 2020-05-08 17:41 test/pdb_ligands_sdf/4hcq_gn1.sdf
    3362 2020-05-08 17:41 test/pdb_ligands_sdf/3kvl_7z5.sdf
    3726 2020-05-08 17:41 test/pdb_ligands_sdf/1uum_afi.sdf
    2300 2020-05-08 17:41 test/pdb_ligands_sdf/4y2r_49o.sdf
    4050 2020-05-08 17:41 test/pdb_ligands_sdf/1x70_715.sdf
    4433 2020-05-08 17:41 test/pdb_ligands_sdf/5ear_5mq.sdf
    5050 2020-05-08 17:41 test/pdb_ligands_sdf/4nqn_y1z.sdf
    2694 2020-05-08 17:41 test/pdb_ligands_sdf/5v8r_90j.sdf
    5130 2020-05-08 17:41 test/pdb_ligands_sdf/1seu_sa3.sdf
    2183 2020-05-08 17:41 test/pdb_ligands_sdf/3kxn_k8x.sdf
    2075 2020-05-08 17:41 test/pdb_ligands_sdf/1z2l_1al.sdf
    3744 2020-05-08 17:41 test/pdb_ligands_sdf/2of8_bni.sdf
    4637 2020-05-08 17:41 test/pdb_ligands_sdf/3dok_gwj.sdf
    2348 2020-05-08 17:41 test/pdb_ligands_sdf/2hb9_l13.sdf
    2117 2020-05-08 17:41 test/pdb_ligands_sdf/5e3g_5jq.sdf
    4026 2020-05-08 17:41 test/pdb_ligands_sdf/4zx1_5l3.sdf
    4222 2020-05-08 17:41 test/pdb_ligands_sdf/3dtw_a96.sdf
    4728 2020-05-08 17:41 test/pdb_ligands_sdf/7upj_inu.sdf
    3785 2020-05-08 17:41 test/pdb_ligands_sdf/4yz7_9ar.sdf
    4739 2020-05-08 17:41 test/pdb_ligands_sdf/4jpa_az6.sdf
    2672 2020-05-08 17:41 test/pdb_ligands_sdf/3q7d_npx.sdf
    1818 2020-05-08 17:41 test/pdb_ligands_sdf/3cn8_spd.sdf
    4068 2020-05-08 17:41 test/pdb_ligands_sdf/5c5e_52m.sdf
    6384 2020-05-08 17:41 test/pdb_ligands_sdf/3ir7_md1.sdf
    2915 2020-05-08 17:41 test/pdb_ligands_sdf/4x2g_3wk.sdf
    2787 2020-05-08 17:41 test/pdb_ligands_sdf/3rr3_flr.sdf
    3755 2020-05-08 17:41 test/pdb_ligands_sdf/4ebw_0pf.sdf
    2251 2020-05-08 17:41 test/pdb_ligands_sdf/2qmy_ad1.sdf
    2407 2020-05-08 17:41 test/pdb_ligands_sdf/2fg6_sn0.sdf
    6502 2020-05-08 17:41 test/pdb_ligands_sdf/5tqg_7ks.sdf
    3918 2020-05-08 17:41 test/pdb_ligands_sdf/5dda_59m.sdf
    2821 2020-05-08 17:41 test/pdb_ligands_sdf/2xbl_m7p.sdf
    2080 2020-05-08 17:41 test/pdb_ligands_sdf/5u5z_7vp.sdf
    2831 2020-05-08 17:41 test/pdb_ligands_sdf/3rr4_hrd.sdf
    3293 2020-05-08 17:41 test/pdb_ligands_sdf/3szc_dcq.sdf
    3017 2020-05-08 17:41 test/pdb_ligands_sdf/1b8o_imh.sdf
    2359 2020-05-08 17:41 test/pdb_ligands_sdf/3gr2_gf4.sdf
    3659 2020-05-08 17:41 test/pdb_ligands_sdf/3mtb_23v.sdf
    2426 2020-05-08 17:41 test/pdb_ligands_sdf/4fr8_tng.sdf
    3461 2020-05-08 17:41 test/pdb_ligands_sdf/1zjp_dr4.sdf
    5818 2020-05-08 17:41 test/pdb_ligands_sdf/1wv7_5pi.sdf
    3057 2020-05-08 17:41 test/pdb_ligands_sdf/5kql_6vy.sdf
    3367 2020-05-08 17:41 test/pdb_ligands_sdf/5fbi_5wd.sdf
    3910 2020-05-08 17:41 test/pdb_ligands_sdf/6bcz_d7y.sdf
    4580 2020-05-08 17:41 test/pdb_ligands_sdf/2vz7_pxi.sdf
    3275 2020-05-08 17:41 test/pdb_ligands_sdf/4m3g_2g1.sdf
    4369 2020-05-08 17:41 test/pdb_ligands_sdf/3sl8_jn7.sdf
    3976 2020-05-08 17:41 test/pdb_ligands_sdf/3g4i_d71.sdf
    3524 2020-05-08 17:41 test/pdb_ligands_sdf/5ti3_7cg.sdf
    3646 2020-05-08 17:41 test/pdb_ligands_sdf/4cb5_93g.sdf
    1926 2020-05-08 17:41 test/pdb_ligands_sdf/2jbt_4hp.sdf
    4626 2020-05-08 17:41 test/pdb_ligands_sdf/5hbh_5y7.sdf
    4438 2020-05-08 17:41 test/pdb_ligands_sdf/3oyl_zzx.sdf
    4755 2020-05-08 17:41 test/pdb_ligands_sdf/1ouy_094.sdf
    2659 2020-05-08 17:41 test/pdb_ligands_sdf/1ivd_st1.sdf
    4031 2020-05-08 17:41 test/pdb_ligands_sdf/5j3j_hl1.sdf
    3684 2020-05-08 17:41 test/pdb_ligands_sdf/4cb7_41g.sdf
    3398 2020-05-08 17:41 test/pdb_ligands_sdf/5anq_5yq.sdf
    2184 2020-05-08 17:41 test/pdb_ligands_sdf/4bi0_z0w.sdf
    4864 2020-05-08 17:41 test/pdb_ligands_sdf/4htx_19f.sdf
    2995 2020-05-08 17:41 test/pdb_ligands_sdf/3h03_ubp.sdf
    3514 2020-05-08 17:41 test/pdb_ligands_sdf/5llh_v49.sdf
    2673 2020-05-08 17:41 test/pdb_ligands_sdf/4qsx_38s.sdf
    2807 2020-05-08 17:41 test/pdb_ligands_sdf/5l4i_6j3.sdf
    4409 2020-05-08 17:41 test/pdb_ligands_sdf/2isp_ggh.sdf
    2585 2020-05-08 17:41 test/pdb_ligands_sdf/4phm_2ud.sdf
    2863 2020-05-08 17:41 test/pdb_ligands_sdf/5aok_goh.sdf
    3379 2020-05-08 17:41 test/pdb_ligands_sdf/2hnz_pc0.sdf
    2994 2020-05-08 17:41 test/pdb_ligands_sdf/5av0_47x.sdf
    3297 2020-05-08 17:41 test/pdb_ligands_sdf/4is9_ltf.sdf
    1970 2020-05-08 17:41 test/pdb_ligands_sdf/5mov_hc4.sdf
    2975 2020-05-08 17:41 test/pdb_ligands_sdf/1j20_as1.sdf
    3506 2020-05-08 17:41 test/pdb_ligands_sdf/4xjl_41f.sdf
    3760 2020-05-08 17:41 test/pdb_ligands_sdf/2pu2_dk2.sdf
    3757 2020-05-08 17:41 test/pdb_ligands_sdf/1o5e_132.sdf
    5144 2020-05-08 17:41 test/pdb_ligands_sdf/5dhr_5aj.sdf
    3958 2020-05-08 17:41 test/pdb_ligands_sdf/4kch_h38.sdf
    3974 2020-05-08 17:41 test/pdb_ligands_sdf/4u6a_3dn.sdf
    4030 2020-05-08 17:41 test/pdb_ligands_sdf/4qyg_3dw.sdf
    2693 2020-05-08 17:41 test/pdb_ligands_sdf/1ki7_id2.sdf
    2349 2020-05-08 17:41 test/pdb_ligands_sdf/4j9z_1kp.sdf
    4126 2020-05-08 17:41 test/pdb_ligands_sdf/5hlm_b9f.sdf
    3860 2020-05-08 17:41 test/pdb_ligands_sdf/4h2t_g5a.sdf
    6463 2020-05-08 17:41 test/pdb_ligands_sdf/3kjs_nap.sdf
    4583 2020-05-08 17:41 test/pdb_ligands_sdf/5ixk_6ew.sdf
    3366 2020-05-08 17:41 test/pdb_ligands_sdf/5adj_m94.sdf
    3790 2020-05-08 17:41 test/pdb_ligands_sdf/3iph_g11.sdf
    3220 2020-05-08 17:41 test/pdb_ligands_sdf/3me6_cge.sdf
    1834 2020-05-08 17:41 test/pdb_ligands_sdf/5uda_cae.sdf
    3426 2020-05-08 17:41 test/pdb_ligands_sdf/5lyw_7bh.sdf
    3897 2020-05-08 17:41 test/pdb_ligands_sdf/3qih_ni7.sdf
    3781 2020-05-08 17:41 test/pdb_ligands_sdf/3ed1_ga3.sdf
    2617 2020-05-08 17:41 test/pdb_ligands_sdf/3t55_4rg.sdf
    2064 2020-05-08 17:41 test/pdb_ligands_sdf/1lwv_ang.sdf
    1938 2020-05-08 17:41 test/pdb_ligands_sdf/5clp_42j.sdf
    1921 2020-05-08 17:41 test/pdb_ligands_sdf/1ck6_sha.sdf
    6061 2020-05-08 17:41 test/pdb_ligands_sdf/3wsj_mk1.sdf
    1592 2020-05-08 17:41 test/pdb_ligands_sdf/3fst_mry.sdf
    2685 2020-05-08 17:41 test/pdb_ligands_sdf/4ie1_1ec.sdf
    4000 2020-05-08 17:41 test/pdb_ligands_sdf/5dqi_dcp.sdf
    3516 2020-05-08 17:41 test/pdb_ligands_sdf/5uis_8c1.sdf
    1750 2020-05-08 17:41 test/pdb_ligands_sdf/1nbe_mlt.sdf
    4497 2020-05-08 17:41 test/pdb_ligands_sdf/5t97_782.sdf
    4476 2020-05-08 17:41 test/pdb_ligands_sdf/5lyf_7b6.sdf
    4325 2020-05-08 17:41 test/pdb_ligands_sdf/5upf_8hv.sdf
    3750 2020-05-08 17:41 test/pdb_ligands_sdf/4iku_shx.sdf
    3616 2020-05-08 17:41 test/pdb_ligands_sdf/4dhm_0kb.sdf
    3442 2020-05-08 17:41 test/pdb_ligands_sdf/5jhk_6k8.sdf
    4087 2020-05-08 17:41 test/pdb_ligands_sdf/3po4_dds.sdf
    5012 2020-05-08 17:41 test/pdb_ligands_sdf/3qpp_pfw.sdf
    3631 2020-05-08 17:41 test/pdb_ligands_sdf/4g8y_0ft.sdf
    3211 2020-05-08 17:41 test/pdb_ligands_sdf/2hck_que.sdf
    2727 2020-05-08 17:41 test/pdb_ligands_sdf/3k3l_dbs.sdf
    2531 2020-05-08 17:41 test/pdb_ligands_sdf/3v1m_hpk.sdf
    4643 2020-05-08 17:41 test/pdb_ligands_sdf/4hvb_19p.sdf
    2902 2020-05-08 17:41 test/pdb_ligands_sdf/2h7j_p15.sdf
    2268 2020-05-08 17:41 test/pdb_ligands_sdf/4h5e_ipr.sdf
    3325 2020-05-08 17:41 test/pdb_ligands_sdf/1l4g_ncn.sdf
    1981 2020-05-08 17:41 test/pdb_ligands_sdf/3gko_aza.sdf
    3163 2020-05-08 17:41 test/pdb_ligands_sdf/4wdx_wdx.sdf
    3765 2020-05-08 17:41 test/pdb_ligands_sdf/3zr7_or8.sdf
    2893 2020-05-08 17:41 test/pdb_ligands_sdf/2cl5_bie.sdf
    3157 2020-05-08 17:41 test/pdb_ligands_sdf/4but_31f.sdf
    3490 2020-05-08 17:41 test/pdb_ligands_sdf/4np9_i3p.sdf
    3157 2020-05-08 17:41 test/pdb_ligands_sdf/5fl6_y0r.sdf
    3223 2020-05-08 17:41 test/pdb_ligands_sdf/4bdk_rqq.sdf
    3620 2020-05-08 17:41 test/pdb_ligands_sdf/2v3i_xx6.sdf
    3915 2020-05-08 17:41 test/pdb_ligands_sdf/4jyh_jyh.sdf
    2202 2020-05-08 17:41 test/pdb_ligands_sdf/2oyf_iac.sdf
    4991 2020-05-08 17:41 test/pdb_ligands_sdf/3km4_22x.sdf
    3303 2020-05-08 17:41 test/pdb_ligands_sdf/5oy6_b4e.sdf
    1824 2020-05-08 17:41 test/pdb_ligands_sdf/4cys_sv7.sdf
    4451 2020-05-08 17:41 test/pdb_ligands_sdf/3orn_3or.sdf
    4332 2020-05-08 17:41 test/pdb_ligands_sdf/3v7t_0gx.sdf
    3844 2020-05-08 17:41 test/pdb_ligands_sdf/5f1z_5u3.sdf
    4585 2020-05-08 17:41 test/pdb_ligands_sdf/4y7a_987.sdf
    4624 2020-05-08 17:41 test/pdb_ligands_sdf/5t4h_75j.sdf
    3554 2020-05-08 17:41 test/pdb_ligands_sdf/5nj0_8yw.sdf
    3315 2020-05-08 17:41 test/pdb_ligands_sdf/4z1n_4kd.sdf
    6139 2020-05-08 17:41 test/pdb_ligands_sdf/5qby_n2a.sdf
    3875 2020-05-08 17:41 test/pdb_ligands_sdf/3u7n_uhf.sdf
    4335 2020-05-08 17:41 test/pdb_ligands_sdf/3qj5_022.sdf
    1855 2020-05-08 17:41 test/pdb_ligands_sdf/3kqw_es9.sdf
    4972 2020-05-08 17:41 test/pdb_ligands_sdf/4jbs_p52.sdf
    5524 2020-05-08 17:41 test/pdb_ligands_sdf/2bel_cbo.sdf
    4721 2020-05-08 17:41 test/pdb_ligands_sdf/2pgl_n1c.sdf
    2178 2020-05-08 17:41 test/pdb_ligands_sdf/1sxg_171.sdf
    3193 2020-05-08 17:41 test/pdb_ligands_sdf/4hvx_qei.sdf
    5141 2020-05-08 17:41 test/pdb_ligands_sdf/1pub_3ph.sdf
    1965 2020-05-08 17:41 test/pdb_ligands_sdf/2qu9_eug.sdf
    3882 2020-05-08 17:41 test/pdb_ligands_sdf/1zyx_lcf.sdf
    4697 2020-05-08 17:41 test/pdb_ligands_sdf/3biz_61e.sdf
    3292 2020-05-08 17:41 test/pdb_ligands_sdf/3k45_51p.sdf
    3725 2020-05-08 17:41 test/pdb_ligands_sdf/1ivr_cba.sdf
    4432 2020-05-08 17:41 test/pdb_ligands_sdf/3zxt_acp.sdf
    2598 2020-05-08 17:41 test/pdb_ligands_sdf/2pd3_tcl.sdf
    1886 2020-05-08 17:41 test/pdb_ligands_sdf/1kgt_pml.sdf
    4652 2020-05-08 17:41 test/pdb_ligands_sdf/4zjr_4p3.sdf
    4718 2020-05-08 17:41 test/pdb_ligands_sdf/3m51_yr1.sdf
    3229 2020-05-08 17:41 test/pdb_ligands_sdf/3lau_ofi.sdf
    3141 2020-05-08 17:41 test/pdb_ligands_sdf/3tu9_5mm.sdf
    1692 2020-05-08 17:41 test/pdb_ligands_sdf/1ism_nca.sdf
    5804 2020-05-08 17:41 test/pdb_ligands_sdf/1gnq_cag.sdf
    5379 2020-05-08 17:41 test/pdb_ligands_sdf/2az5_307.sdf
    3476 2020-05-08 17:41 test/pdb_ligands_sdf/5v7w_91j.sdf
    5929 2020-05-08 17:41 test/pdb_ligands_sdf/5fdr_5x3.sdf
    8034 2020-05-08 17:41 test/pdb_ligands_sdf/5x8g_s0n.sdf
    4011 2020-05-08 17:41 test/pdb_ligands_sdf/3kwf_b1q.sdf
    4918 2020-05-08 17:41 test/pdb_ligands_sdf/4mq4_2d5.sdf
    2901 2020-05-08 17:41 test/pdb_ligands_sdf/4bel_b3p.sdf
    4730 2020-05-08 17:41 test/pdb_ligands_sdf/4u96_lmt.sdf
    1616 2020-05-08 17:41 test/pdb_ligands_sdf/3qro_dtd.sdf
    2300 2020-05-08 17:41 test/pdb_ligands_sdf/2cxp_a5p.sdf
    3889 2020-05-08 17:41 test/pdb_ligands_sdf/3t07_09c.sdf
    4435 2020-05-08 17:41 test/pdb_ligands_sdf/2a3x_cpk.sdf
    3345 2020-05-08 17:41 test/pdb_ligands_sdf/4fli_y16.sdf
    3621 2020-05-08 17:41 test/pdb_ligands_sdf/1maq_pgu.sdf
    2930 2020-05-08 17:41 test/pdb_ligands_sdf/1fbg_ahm.sdf
    1729 2020-05-08 17:41 test/pdb_ligands_sdf/3fl1_cgp.sdf
    2066 2020-05-08 17:41 test/pdb_ligands_sdf/5tjy_pdc.sdf
    2854 2020-05-08 17:41 test/pdb_ligands_sdf/5lx6_78p.sdf
    3447 2020-05-08 17:41 test/pdb_ligands_sdf/4poj_2vp.sdf
    4442 2020-05-08 17:41 test/pdb_ligands_sdf/4fto_3hk.sdf
    2879 2020-05-08 17:41 test/pdb_ligands_sdf/1rgb_eld.sdf
    5821 2020-05-08 17:41 test/pdb_ligands_sdf/4ot5_481.sdf
    4264 2020-05-08 17:41 test/pdb_ligands_sdf/5f9e_5vs.sdf
    6609 2020-05-08 17:41 test/pdb_ligands_sdf/3zkp_erb.sdf
    2317 2020-05-08 17:41 test/pdb_ligands_sdf/5ioz_6c4.sdf
    3399 2020-05-08 17:41 test/pdb_ligands_sdf/4ram_pnm.sdf
    4928 2020-05-08 17:41 test/pdb_ligands_sdf/5pzl_8xv.sdf
    3404 2020-05-08 17:41 test/pdb_ligands_sdf/1cq7_py5.sdf
    3940 2020-05-08 17:41 test/pdb_ligands_sdf/4ivw_1gj.sdf
    2815 2020-05-08 17:41 test/pdb_ligands_sdf/5tmd_7e0.sdf
    4301 2020-05-08 17:41 test/pdb_ligands_sdf/4oc1_2qs.sdf
    4089 2020-05-08 17:41 test/pdb_ligands_sdf/3f0x_53t.sdf
    5271 2020-05-08 17:41 test/pdb_ligands_sdf/2xnp_wcx.sdf
    3164 2020-05-08 17:41 test/pdb_ligands_sdf/3i6r_j5z.sdf
    2583 2020-05-08 17:41 test/pdb_ligands_sdf/3gt3_brv.sdf
    4343 2020-05-08 17:41 test/pdb_ligands_sdf/5fc4_5wl.sdf
    3017 2020-05-08 17:41 test/pdb_ligands_sdf/2h4k_509.sdf
    1904 2020-05-08 17:41 test/pdb_ligands_sdf/3gqe_bcn.sdf
    2457 2020-05-08 17:41 test/pdb_ligands_sdf/4y58_47l.sdf
    2572 2020-05-08 17:41 test/pdb_ligands_sdf/2wcl_b8m.sdf
    3675 2020-05-08 17:41 test/pdb_ligands_sdf/4py4_xl2.sdf
    4247 2020-05-08 17:41 test/pdb_ligands_sdf/4lbu_1wj.sdf
    4332 2020-05-08 17:41 test/pdb_ligands_sdf/2xb5_i7t.sdf
    4456 2020-05-08 17:41 test/pdb_ligands_sdf/5hin_1kl.sdf
    3370 2020-05-08 17:41 test/pdb_ligands_sdf/3ps6_3ps.sdf
    3669 2020-05-08 17:41 test/pdb_ligands_sdf/3mtf_a3f.sdf
    2876 2020-05-08 17:41 test/pdb_ligands_sdf/5t8j_77t.sdf
    4002 2020-05-08 17:41 test/pdb_ligands_sdf/3ac1_kzi.sdf
    2192 2020-05-08 17:41 test/pdb_ligands_sdf/2per_mnb.sdf
    1996 2020-05-08 17:41 test/pdb_ligands_sdf/4l6g_cnl.sdf
    3774 2020-05-08 17:41 test/pdb_ligands_sdf/4l7l_1va.sdf
    3768 2020-05-08 17:41 test/pdb_ligands_sdf/3pcu_lx8.sdf
    3071 2020-05-08 17:41 test/pdb_ligands_sdf/5lqn_72o.sdf
    2431 2020-05-08 17:41 test/pdb_ligands_sdf/1uf8_ing.sdf
    4466 2020-05-08 17:41 test/pdb_ligands_sdf/4yl3_4u9.sdf
    4064 2020-05-08 17:41 test/pdb_ligands_sdf/1n4q_mgm.sdf
    2491 2020-05-08 17:41 test/pdb_ligands_sdf/1iss_mcg.sdf
    2197 2020-05-08 17:41 test/pdb_ligands_sdf/4xp2_tt4.sdf
    4077 2020-05-08 17:41 test/pdb_ligands_sdf/2op9_wr1.sdf
    5513 2020-05-08 17:41 test/pdb_ligands_sdf/2q6c_hr1.sdf
    4356 2020-05-08 17:41 test/pdb_ligands_sdf/4tn6_pfo.sdf
    2933 2020-05-08 17:41 test/pdb_ligands_sdf/1gi6_124.sdf
    4043 2020-05-08 17:41 test/pdb_ligands_sdf/4g2j_0wf.sdf
    2344 2020-05-08 17:41 test/pdb_ligands_sdf/1hnn_skf.sdf
    3560 2020-05-08 17:41 test/pdb_ligands_sdf/3k3b_l31.sdf
    3379 2020-05-08 17:41 test/pdb_ligands_sdf/3sax_e50.sdf
    5167 2020-05-08 17:41 test/pdb_ligands_sdf/5jog_6lt.sdf
    4512 2020-05-08 17:41 test/pdb_ligands_sdf/3oro_ags.sdf
    2981 2020-05-08 17:41 test/pdb_ligands_sdf/1jlq_sbn.sdf
    4083 2020-05-08 17:41 test/pdb_ligands_sdf/5tzx_7oy.sdf
    4704 2020-05-08 17:41 test/pdb_ligands_sdf/5d48_l96.sdf
    3150 2020-05-08 17:41 test/pdb_ligands_sdf/3ene_npz.sdf
    4477 2020-05-08 17:41 test/pdb_ligands_sdf/2qu5_276.sdf
    2471 2020-05-08 17:41 test/pdb_ligands_sdf/5mri_q9y.sdf
    4044 2020-05-08 17:41 test/pdb_ligands_sdf/4ec0_7pq.sdf
    3600 2020-05-08 17:41 test/pdb_ligands_sdf/1t9c_1sm.sdf
    1984 2020-05-08 17:41 test/pdb_ligands_sdf/5hpw_3cj.sdf
    5705 2020-05-08 17:41 test/pdb_ligands_sdf/3moo_vea.sdf
    5684 2020-05-08 17:41 test/pdb_ligands_sdf/4tos_355.sdf
    4667 2020-05-08 17:41 test/pdb_ligands_sdf/2y76_cb7.sdf
    5535 2020-05-08 17:41 test/pdb_ligands_sdf/4lge_1y0.sdf
    6200 2020-05-08 17:41 test/pdb_ligands_sdf/2bvn_enx.sdf
    1993 2020-05-08 17:41 test/pdb_ligands_sdf/3ril_3rk.sdf
    4069 2020-05-08 17:41 test/pdb_ligands_sdf/3pnh_8cx.sdf
    1854 2020-05-08 17:41 test/pdb_ligands_sdf/3vsj_2xp.sdf
    2541 2020-05-08 17:41 test/pdb_ligands_sdf/2put_f6r.sdf
    2638 2020-05-08 17:41 test/pdb_ligands_sdf/3ttr_lqz.sdf
    6729 2020-05-08 17:41 test/pdb_ligands_sdf/4oca_2qr.sdf
    3924 2020-05-08 17:41 test/pdb_ligands_sdf/5edr_5n4.sdf
    2609 2020-05-08 17:41 test/pdb_ligands_sdf/5kr7_6x9.sdf
    2893 2020-05-08 17:41 test/pdb_ligands_sdf/4hlw_17w.sdf
    5102 2020-05-08 17:41 test/pdb_ligands_sdf/6evd_byn.sdf
    5302 2020-05-08 17:41 test/pdb_ligands_sdf/2zir_nh7.sdf
    3305 2020-05-08 17:41 test/pdb_ligands_sdf/3m1z_bmp.sdf
    3269 2020-05-08 17:41 test/pdb_ligands_sdf/3gzj_evs.sdf
    3666 2020-05-08 17:41 test/pdb_ligands_sdf/5ehj_5k5.sdf
    3809 2020-05-08 17:41 test/pdb_ligands_sdf/4ijh_1ej.sdf
    4346 2020-05-08 17:41 test/pdb_ligands_sdf/4yjr_4dj.sdf
    3065 2020-05-08 17:41 test/pdb_ligands_sdf/1equ_eqi.sdf
    6270 2020-05-08 17:41 test/pdb_ligands_sdf/1bzl_gcg.sdf
    4103 2020-05-08 17:41 test/pdb_ligands_sdf/2jcs_ttp.sdf
    3178 2020-05-08 17:41 test/pdb_ligands_sdf/2j9y_foo.sdf
    3359 2020-05-08 17:41 test/pdb_ligands_sdf/4d9e_lcs.sdf
    4695 2020-05-08 17:41 test/pdb_ligands_sdf/4qdd_30q.sdf
    5508 2020-05-08 17:41 test/pdb_ligands_sdf/7cpa_fvf.sdf
    2321 2020-05-08 17:41 test/pdb_ligands_sdf/5hh5_60m.sdf
    5832 2020-05-08 17:41 test/pdb_ligands_sdf/3ozw_dgg.sdf
    1789 2020-05-08 17:41 test/pdb_ligands_sdf/4utz_0l1.sdf
    5338 2020-05-08 17:41 test/pdb_ligands_sdf/4ced_9ns.sdf
    3067 2020-05-08 17:41 test/pdb_ligands_sdf/2q8m_fbp.sdf
    4008 2020-05-08 17:41 test/pdb_ligands_sdf/5kns_3l7.sdf
    4112 2020-05-08 17:41 test/pdb_ligands_sdf/5uj3_ce4.sdf
    5048 2020-05-08 17:41 test/pdb_ligands_sdf/5enp_5qf.sdf
    2825 2020-05-08 17:41 test/pdb_ligands_sdf/5dr1_5gj.sdf
    3124 2020-05-08 17:41 test/pdb_ligands_sdf/5hs6_j3z.sdf
    3931 2020-05-08 17:41 test/pdb_ligands_sdf/3wha_wha.sdf
    3623 2020-05-08 17:41 test/pdb_ligands_sdf/1boz_prd.sdf
    4919 2020-05-08 17:41 test/pdb_ligands_sdf/5q0p_9la.sdf
    5733 2020-05-08 17:41 test/pdb_ligands_sdf/1o48_853.sdf
    2372 2020-05-08 17:41 test/pdb_ligands_sdf/4mqs_ixo.sdf
    2425 2020-05-08 17:41 test/pdb_ligands_sdf/1o4j_is2.sdf
    4816 2020-05-08 17:41 test/pdb_ligands_sdf/2pid_ysa.sdf
    5262 2020-05-08 17:41 test/pdb_ligands_sdf/5mo4_nil.sdf
    1798 2020-05-08 17:41 test/pdb_ligands_sdf/3hkv_3ab.sdf
    2571 2020-05-08 17:41 test/pdb_ligands_sdf/4yqj_4gt.sdf
    1973 2020-05-08 17:41 test/pdb_ligands_sdf/1kww_mfu.sdf
    2204 2020-05-08 17:41 test/pdb_ligands_sdf/5cna_mma.sdf
    5754 2020-05-08 17:41 test/pdb_ligands_sdf/3udl_kli.sdf
    2065 2020-05-08 17:41 test/pdb_ligands_sdf/4bde_cws.sdf
    3373 2020-05-08 17:41 test/pdb_ligands_sdf/3m98_e02.sdf
    2537 2020-05-08 17:41 test/pdb_ligands_sdf/3h63_nhc.sdf
    2692 2020-05-08 17:41 test/pdb_ligands_sdf/1l3l_lae.sdf
    5132 2020-05-08 17:41 test/pdb_ligands_sdf/3irx_udr.sdf
    3000 2020-05-08 17:41 test/pdb_ligands_sdf/1m2q_mnx.sdf
    2341 2020-05-08 17:41 test/pdb_ligands_sdf/5if8_6ax.sdf
    4301 2020-05-08 17:41 test/pdb_ligands_sdf/4g2w_ni0.sdf
    4271 2020-05-08 17:41 test/pdb_ligands_sdf/2est_2z5.sdf
    2868 2020-05-08 17:41 test/pdb_ligands_sdf/4ca4_kgm.sdf
    6428 2020-05-08 17:41 test/pdb_ligands_sdf/2jcv_ndp.sdf
    4056 2020-05-08 17:41 test/pdb_ligands_sdf/5pzm_8xs.sdf
    6189 2020-05-08 17:41 test/pdb_ligands_sdf/1nco_chr.sdf
    4693 2020-05-08 17:41 test/pdb_ligands_sdf/3zc6_vfc.sdf
    4002 2020-05-08 17:41 test/pdb_ligands_sdf/5cb4_tiv.sdf
    2710 2020-05-08 17:41 test/pdb_ligands_sdf/3n2y_tef.sdf
    3637 2020-05-08 17:41 test/pdb_ligands_sdf/5gmn_949.sdf
    3087 2020-05-08 17:41 test/pdb_ligands_sdf/4a8v_2an.sdf
    2863 2020-05-08 17:41 test/pdb_ligands_sdf/4wdt_wdt.sdf
    3702 2020-05-08 17:41 test/pdb_ligands_sdf/3srw_q27.sdf
    4046 2020-05-08 17:41 test/pdb_ligands_sdf/2uwp_894.sdf
    4597 2020-05-08 17:41 test/pdb_ligands_sdf/5u3q_7uj.sdf
    3621 2020-05-08 17:41 test/pdb_ligands_sdf/2bre_kj2.sdf
    3362 2020-05-08 17:41 test/pdb_ligands_sdf/3rm8_rm8.sdf
    4799 2020-05-08 17:41 test/pdb_ligands_sdf/4otq_2v2.sdf
    3238 2020-05-08 17:41 test/pdb_ligands_sdf/1yry_msg.sdf
    4728 2020-05-08 17:41 test/pdb_ligands_sdf/4ppc_2vw.sdf
    2664 2020-05-08 17:41 test/pdb_ligands_sdf/5kk4_44e.sdf
    9946 2020-05-08 17:41 test/pdb_ligands_sdf/2ji7_oxt.sdf
    4145 2020-05-08 17:41 test/pdb_ligands_sdf/1v39_m7g.sdf
    6151 2020-05-08 17:41 test/pdb_ligands_sdf/1xdg_ab8.sdf
    2117 2020-05-08 17:41 test/pdb_ligands_sdf/3fvi_osf.sdf
    6722 2020-05-08 17:41 test/pdb_ligands_sdf/4ca6_3ef.sdf
    3212 2020-05-08 17:41 test/pdb_ligands_sdf/3uzz_asd.sdf
    5514 2020-05-08 17:41 test/pdb_ligands_sdf/3fzm_3go.sdf
    2987 2020-05-08 17:41 test/pdb_ligands_sdf/1opb_ret.sdf
    2665 2020-05-08 17:41 test/pdb_ligands_sdf/5eqe_5r8.sdf
    4036 2020-05-08 17:41 test/pdb_ligands_sdf/2j51_dki.sdf
    4446 2020-05-08 17:41 test/pdb_ligands_sdf/3rgf_bax.sdf
    2631 2020-05-08 17:41 test/pdb_ligands_sdf/3p6x_c3q.sdf
    4756 2020-05-08 17:41 test/pdb_ligands_sdf/1re8_bd2.sdf
    3537 2020-05-08 17:41 test/pdb_ligands_sdf/4jq4_imn.sdf
    2319 2020-05-08 17:41 test/pdb_ligands_sdf/1gkl_fer.sdf
    3226 2020-05-08 17:41 test/pdb_ligands_sdf/3f07_age.sdf
    4549 2020-05-08 17:41 test/pdb_ligands_sdf/2v13_c40.sdf
    4945 2020-05-08 17:41 test/pdb_ligands_sdf/4ez5_0rs.sdf
    2630 2020-05-08 17:41 test/pdb_ligands_sdf/2w66_hq6.sdf
    4966 2020-05-08 17:41 test/pdb_ligands_sdf/4p3p_2cr.sdf
    4305 2020-05-08 17:41 test/pdb_ligands_sdf/4qmq_34u.sdf
    3934 2020-05-08 17:41 test/pdb_ligands_sdf/3neo_g24.sdf
    3186 2020-05-08 17:41 test/pdb_ligands_sdf/4bo6_36p.sdf
    4375 2020-05-08 17:41 test/pdb_ligands_sdf/5dxh_5h2.sdf
    2485 2020-05-08 17:41 test/pdb_ligands_sdf/5ikb_kai.sdf
    3564 2020-05-08 17:41 test/pdb_ligands_sdf/3wf6_fz9.sdf
    3051 2020-05-08 17:41 test/pdb_ligands_sdf/5d29_5q1.sdf
    1251 2020-05-08 17:41 test/pdb_ligands_sdf/4xn9_bal.sdf
    5861 2020-05-08 17:41 test/pdb_ligands_sdf/1ebu_nda.sdf
    3886 2020-05-08 17:41 test/pdb_ligands_sdf/1h9u_lg2.sdf
    4252 2020-05-08 17:41 test/pdb_ligands_sdf/5b5p_wnn.sdf
    2187 2020-05-08 17:41 test/pdb_ligands_sdf/2ai8_sb7.sdf
    3190 2020-05-08 17:41 test/pdb_ligands_sdf/5al1_gn5.sdf
    3619 2020-05-08 17:41 test/pdb_ligands_sdf/3sn7_540.sdf
    5453 2020-05-08 17:41 test/pdb_ligands_sdf/5q0m_9l1.sdf
    3617 2020-05-08 17:41 test/pdb_ligands_sdf/4umu_0v0.sdf
    2073 2020-05-08 17:41 test/pdb_ligands_sdf/5sw3_46l.sdf
    1961 2020-05-08 17:41 test/pdb_ligands_sdf/4ws4_5nu.sdf
    3092 2020-05-08 17:41 test/pdb_ligands_sdf/4qzu_rtl.sdf
    4307 2020-05-08 17:41 test/pdb_ligands_sdf/2wyg_461.sdf
    2467 2020-05-08 17:41 test/pdb_ligands_sdf/2e4v_2cg.sdf
    2821 2020-05-08 17:41 test/pdb_ligands_sdf/2yc3_mw5.sdf
    3448 2020-05-08 17:41 test/pdb_ligands_sdf/2qcm_jw5.sdf
    4037 2020-05-08 17:41 test/pdb_ligands_sdf/4no7_2n8.sdf
    1820 2020-05-08 17:41 test/pdb_ligands_sdf/4g6w_pbx.sdf
    7655 2020-05-08 17:41 test/pdb_ligands_sdf/3bc3_opt.sdf
    4032 2020-05-08 17:41 test/pdb_ligands_sdf/3uo4_0c0.sdf
    3177 2020-05-08 17:41 test/pdb_ligands_sdf/3tp0_fo5.sdf
    5297 2020-05-08 17:41 test/pdb_ligands_sdf/2igy_a2t.sdf
    3244 2020-05-08 17:41 test/pdb_ligands_sdf/3nj1_pyv.sdf
    2262 2020-05-08 17:41 test/pdb_ligands_sdf/4b4l_1pe.sdf
    3484 2020-05-08 17:41 test/pdb_ligands_sdf/3g0u_mdy.sdf
    2684 2020-05-08 17:41 test/pdb_ligands_sdf/2rht_c1e.sdf
    3788 2020-05-08 17:41 test/pdb_ligands_sdf/3x44_pus.sdf
    4194 2020-05-08 17:41 test/pdb_ligands_sdf/3fei_ctm.sdf
    4024 2020-05-08 17:41 test/pdb_ligands_sdf/3d4s_clr.sdf
    3097 2020-05-08 17:41 test/pdb_ligands_sdf/5al3_tgw.sdf
    1849 2020-05-08 17:41 test/pdb_ligands_sdf/5a5z_wjz.sdf
    2074 2020-05-08 17:41 test/pdb_ligands_sdf/4bdg_p3j.sdf
    6803 2020-05-08 17:41 test/pdb_ligands_sdf/5hmh_62r.sdf
    4484 2020-05-08 17:41 test/pdb_ligands_sdf/4uwj_7l5.sdf
    3827 2020-05-08 17:41 test/pdb_ligands_sdf/4pme_cur.sdf
    4732 2020-05-08 17:41 test/pdb_ligands_sdf/2uuh_lmu.sdf
    6131 2020-05-08 17:41 test/pdb_ligands_sdf/2c0o_l2g.sdf
    4454 2020-05-08 17:41 test/pdb_ligands_sdf/4mt9_2d6.sdf
    4998 2020-05-08 17:41 test/pdb_ligands_sdf/4anx_534.sdf
    4158 2020-05-08 17:41 test/pdb_ligands_sdf/4o0b_2qa.sdf
    2075 2020-05-08 17:41 test/pdb_ligands_sdf/5fe1_12q.sdf
    3607 2020-05-08 17:41 test/pdb_ligands_sdf/2zcq_b65.sdf
    3304 2020-05-08 17:41 test/pdb_ligands_sdf/2np6_nea.sdf
    1844 2020-05-08 17:41 test/pdb_ligands_sdf/1nqa_g3h.sdf
    3042 2020-05-08 17:41 test/pdb_ligands_sdf/1u1d_181.sdf
    2841 2020-05-08 17:41 test/pdb_ligands_sdf/3emq_hah.sdf
    4906 2020-05-08 17:41 test/pdb_ligands_sdf/3tv5_rcp.sdf
    3055 2020-05-08 17:41 test/pdb_ligands_sdf/2j3q_tfl.sdf
    2294 2020-05-08 17:41 test/pdb_ligands_sdf/5o0f_iop.sdf
    4859 2020-05-08 17:41 test/pdb_ligands_sdf/2q2y_mkr.sdf
    4615 2020-05-08 17:41 test/pdb_ligands_sdf/5k13_6q7.sdf
    3008 2020-05-08 17:41 test/pdb_ligands_sdf/4a06_a06.sdf
    2430 2020-05-08 17:41 test/pdb_ligands_sdf/3srb_28s.sdf
    4213 2020-05-08 17:41 test/pdb_ligands_sdf/2in6_839.sdf
    3963 2020-05-08 17:41 test/pdb_ligands_sdf/4q19_2xl.sdf
    3095 2020-05-08 17:41 test/pdb_ligands_sdf/1tqt_ssd.sdf
    3346 2020-05-08 17:41 test/pdb_ligands_sdf/2fzg_eob.sdf
    5891 2020-05-08 17:41 test/pdb_ligands_sdf/4qtb_38z.sdf
    2666 2020-05-08 17:41 test/pdb_ligands_sdf/3t4k_emu.sdf
    3078 2020-05-08 17:41 test/pdb_ligands_sdf/1e8v_dan.sdf
    5547 2020-05-08 17:41 test/pdb_ligands_sdf/4z55_4lo.sdf
    5185 2020-05-08 17:41 test/pdb_ligands_sdf/3pz4_3pz.sdf
    1385 2020-05-08 17:41 test/pdb_ligands_sdf/4ptn_gxv.sdf
    3278 2020-05-08 17:41 test/pdb_ligands_sdf/1lhn_aon.sdf
    1673 2020-05-08 17:41 test/pdb_ligands_sdf/2jgi_ae3.sdf
    3746 2020-05-08 17:41 test/pdb_ligands_sdf/5tq6_7gv.sdf
    3610 2020-05-08 17:41 test/pdb_ligands_sdf/2p37_m13.sdf
    3999 2020-05-08 17:41 test/pdb_ligands_sdf/5f1r_42o.sdf
    4688 2020-05-08 17:41 test/pdb_ligands_sdf/3eqf_ksa.sdf
    3175 2020-05-08 17:41 test/pdb_ligands_sdf/2eep_aio.sdf
    4395 2020-05-08 17:41 test/pdb_ligands_sdf/5tkb_7dj.sdf
    4360 2020-05-08 17:41 test/pdb_ligands_sdf/3p76_p76.sdf
    3909 2020-05-08 17:41 test/pdb_ligands_sdf/1pwp_nsc.sdf
    1701 2020-05-08 17:41 test/pdb_ligands_sdf/1hti_pga.sdf
    4791 2020-05-08 17:41 test/pdb_ligands_sdf/3k0v_dxi.sdf
    2389 2020-05-08 17:41 test/pdb_ligands_sdf/3dap_da3.sdf
    2598 2020-05-08 17:41 test/pdb_ligands_sdf/5l03_6zb.sdf
    3461 2020-05-08 17:41 test/pdb_ligands_sdf/2htu_bcz.sdf
    4040 2020-05-08 17:41 test/pdb_ligands_sdf/4cu0_s71.sdf
    5105 2020-05-08 17:41 test/pdb_ligands_sdf/4z2b_4lc.sdf
    2155 2020-05-08 17:41 test/pdb_ligands_sdf/1w8m_e1p.sdf
    1815 2020-05-08 17:41 test/pdb_ligands_sdf/2wz0_zzt.sdf
    4168 2020-05-08 17:41 test/pdb_ligands_sdf/3nlu_3xb.sdf
    5043 2020-05-08 17:41 test/pdb_ligands_sdf/5q0q_9ld.sdf
    2646 2020-05-08 17:41 test/pdb_ligands_sdf/1qy4_6pg.sdf
    2191 2020-05-08 17:41 test/pdb_ligands_sdf/1enu_apz.sdf
    4106 2020-05-08 17:41 test/pdb_ligands_sdf/3rqj_y2b.sdf
    5526 2020-05-08 17:41 test/pdb_ligands_sdf/3qkm_sm9.sdf
    3729 2020-05-08 17:41 test/pdb_ligands_sdf/2rki_tt1.sdf
    3139 2020-05-08 17:41 test/pdb_ligands_sdf/4jsg_q10.sdf
    2286 2020-05-08 17:41 test/pdb_ligands_sdf/4mr8_2bw.sdf
    5007 2020-05-08 17:41 test/pdb_ligands_sdf/1bma_0qh.sdf
    4036 2020-05-08 17:41 test/pdb_ligands_sdf/4qmm_35r.sdf
    6816 2020-05-08 17:41 test/pdb_ligands_sdf/4z2j_m6g.sdf
    8709 2020-05-08 17:41 test/pdb_ligands_sdf/4urm_xam.sdf
    2305 2020-05-08 17:41 test/pdb_ligands_sdf/5ilj_btb.sdf
    5270 2020-05-08 17:41 test/pdb_ligands_sdf/5kr1_017.sdf
    5397 2020-05-08 17:41 test/pdb_ligands_sdf/4rpk_3ua.sdf
    4622 2020-05-08 17:41 test/pdb_ligands_sdf/4wnm_3rt.sdf
    3515 2020-05-08 17:41 test/pdb_ligands_sdf/5alz_xq9.sdf
    3747 2020-05-08 17:41 test/pdb_ligands_sdf/3fun_798.sdf
    4359 2020-05-08 17:41 test/pdb_ligands_sdf/3i0s_rt7.sdf
    3193 2020-05-08 17:41 test/pdb_ligands_sdf/4d9m_0jo.sdf
    1936 2020-05-08 17:41 test/pdb_ligands_sdf/1phf_pim.sdf
    4115 2020-05-08 17:41 test/pdb_ligands_sdf/3rz7_rz7.sdf
    4030 2020-05-08 17:41 test/pdb_ligands_sdf/3d28_b34.sdf
    2996 2020-05-08 17:41 test/pdb_ligands_sdf/2a3c_pnx.sdf
    5007 2020-05-08 17:41 test/pdb_ligands_sdf/4luz_1xt.sdf
    3733 2020-05-08 17:41 test/pdb_ligands_sdf/2byh_2d7.sdf
    5424 2020-05-08 17:41 test/pdb_ligands_sdf/2qhz_mz2.sdf
    3655 2020-05-08 17:41 test/pdb_ligands_sdf/2hxm_302.sdf
    1344 2020-05-08 17:41 test/pdb_ligands_sdf/5k8x_dxe.sdf
    1941 2020-05-08 17:41 test/pdb_ligands_sdf/4a9k_tyl.sdf
    3271 2020-05-08 17:41 test/pdb_ligands_sdf/1ad4_hh2.sdf
    3436 2020-05-08 17:41 test/pdb_ligands_sdf/3avq_mv1.sdf
    3954 2020-05-08 17:41 test/pdb_ligands_sdf/2uw0_gvk.sdf
    3221 2020-05-08 17:41 test/pdb_ligands_sdf/5ieg_6a9.sdf
    2493 2020-05-08 17:41 test/pdb_ligands_sdf/1rm0_d6p.sdf
    2292 2020-05-08 17:41 test/pdb_ligands_sdf/4m8l_5rp.sdf
    4813 2020-05-08 17:41 test/pdb_ligands_sdf/1yin_cm3.sdf
    2369 2020-05-08 17:41 test/pdb_ligands_sdf/5jib_oia.sdf
    5611 2020-05-08 17:41 test/pdb_ligands_sdf/2xog_sfb.sdf
    2552 2020-05-08 17:41 test/pdb_ligands_sdf/4j7u_ytz.sdf
    1593 2020-05-08 17:41 test/pdb_ligands_sdf/5uio_lg3.sdf
    4579 2020-05-08 17:41 test/pdb_ligands_sdf/4rwl_3zc.sdf
    2956 2020-05-08 17:41 test/pdb_ligands_sdf/3iw7_bog.sdf
    5061 2020-05-08 17:41 test/pdb_ligands_sdf/3i7i_518.sdf
    2935 2020-05-08 17:41 test/pdb_ligands_sdf/1lv0_ger.sdf
    2482 2020-05-08 17:41 test/pdb_ligands_sdf/4a0r_dtb.sdf
    3714 2020-05-08 17:41 test/pdb_ligands_sdf/4zs3_a4f.sdf
    3911 2020-05-08 17:41 test/pdb_ligands_sdf/3rtp_34i.sdf
    3143 2020-05-08 17:41 test/pdb_ligands_sdf/5en3_7lu.sdf
    2989 2020-05-08 17:41 test/pdb_ligands_sdf/5c5q_g9w.sdf
    4545 2020-05-08 17:41 test/pdb_ligands_sdf/2r6y_llc.sdf
    2529 2020-05-08 17:41 test/pdb_ligands_sdf/5jt7_6n2.sdf
    4251 2020-05-08 17:41 test/pdb_ligands_sdf/5e0i_5j6.sdf
    4047 2020-05-08 17:41 test/pdb_ligands_sdf/4ftq_4hk.sdf
    2904 2020-05-08 17:41 test/pdb_ligands_sdf/5whc_ajj.sdf
    3543 2020-05-08 17:41 test/pdb_ligands_sdf/4i5p_1d1.sdf
    5419 2020-05-08 17:41 test/pdb_ligands_sdf/4j3e_nut.sdf
    3499 2020-05-08 17:41 test/pdb_ligands_sdf/2vg7_nni.sdf
    4481 2020-05-08 17:41 test/pdb_ligands_sdf/5d10_563.sdf
    2259 2020-05-08 17:41 test/pdb_ligands_sdf/2prl_ddq.sdf
    3797 2020-05-08 17:41 test/pdb_ligands_sdf/4ne2_sh2.sdf
    1872 2020-05-08 17:41 test/pdb_ligands_sdf/3s04_ram.sdf
    2757 2020-05-08 17:41 test/pdb_ligands_sdf/5cub_54v.sdf
    4456 2020-05-08 17:41 test/pdb_ligands_sdf/5ktx_6xh.sdf
    2209 2020-05-08 17:41 test/pdb_ligands_sdf/1m9t_ine.sdf
    4889 2020-05-08 17:41 test/pdb_ligands_sdf/3fi2_jk1.sdf
    3044 2020-05-08 17:41 test/pdb_ligands_sdf/1fpb_fdp.sdf
    3415 2020-05-08 17:41 test/pdb_ligands_sdf/2h4i_lbt.sdf
    3477 2020-05-08 17:41 test/pdb_ligands_sdf/5i8a_69c.sdf
    4266 2020-05-08 17:41 test/pdb_ligands_sdf/4alv_r9p.sdf
    3869 2020-05-08 17:41 test/pdb_ligands_sdf/2ok1_33a.sdf
    3281 2020-05-08 17:41 test/pdb_ligands_sdf/3uzx_aox.sdf
    3426 2020-05-08 17:41 test/pdb_ligands_sdf/4cc6_l5y.sdf
    2827 2020-05-08 17:41 test/pdb_ligands_sdf/3vc4_0fs.sdf
    2335 2020-05-08 17:41 test/pdb_ligands_sdf/4cv8_3d7.sdf
    4632 2020-05-08 17:41 test/pdb_ligands_sdf/1uu7_bi2.sdf
    3814 2020-05-08 17:41 test/pdb_ligands_sdf/5ih8_6bj.sdf
    3495 2020-05-08 17:41 test/pdb_ligands_sdf/1z2p_i3s.sdf
    4959 2020-05-08 17:41 test/pdb_ligands_sdf/4eqz_aw0.sdf
    2354 2020-05-08 17:41 test/pdb_ligands_sdf/3lpu_p03.sdf
    6061 2020-05-08 17:41 test/pdb_ligands_sdf/1nmu_mtt.sdf
    7458 2020-05-08 17:41 test/pdb_ligands_sdf/3huj_agh.sdf
    4089 2020-05-08 17:41 test/pdb_ligands_sdf/1o86_lpr.sdf
    4305 2020-05-08 17:41 test/pdb_ligands_sdf/4jai_xu2.sdf
    1374 2020-05-08 17:41 test/pdb_ligands_sdf/1n4g_pyz.sdf
    7492 2020-05-08 17:41 test/pdb_ligands_sdf/2qv4_qv4.sdf
    4288 2020-05-08 17:41 test/pdb_ligands_sdf/1nyx_drf.sdf
    5959 2020-05-08 17:41 test/pdb_ligands_sdf/5ml6_9gd.sdf
    2434 2020-05-08 17:41 test/pdb_ligands_sdf/2gvv_di9.sdf
    4871 2020-05-08 17:41 test/pdb_ligands_sdf/3l08_zig.sdf
    2560 2020-05-08 17:41 test/pdb_ligands_sdf/5fz0_dj6.sdf
    5043 2020-05-08 17:41 test/pdb_ligands_sdf/4cf1_iy7.sdf
    2738 2020-05-08 17:41 test/pdb_ligands_sdf/4kwf_3ak.sdf
    1636 2020-05-08 17:41 test/pdb_ligands_sdf/5p9w_d1d.sdf
    5017 2020-05-08 17:41 test/pdb_ligands_sdf/1k1j_fd2.sdf
    4173 2020-05-08 17:41 test/pdb_ligands_sdf/3zlq_6t9.sdf
    5753 2020-05-08 17:41 test/pdb_ligands_sdf/4q1p_2xt.sdf
    3699 2020-05-08 17:41 test/pdb_ligands_sdf/4b73_4va.sdf
    3865 2020-05-08 17:41 test/pdb_ligands_sdf/3gql_gql.sdf
    1841 2020-05-08 17:41 test/pdb_ligands_sdf/5t9c_g3p.sdf
    4513 2020-05-08 17:41 test/pdb_ligands_sdf/5u6d_7xg.sdf
    5036 2020-05-08 17:41 test/pdb_ligands_sdf/1xh4_r69.sdf
    4952 2020-05-08 17:41 test/pdb_ligands_sdf/3cso_xni.sdf
    3768 2020-05-08 17:41 test/pdb_ligands_sdf/5eau_fff.sdf
    4475 2020-05-08 17:41 test/pdb_ligands_sdf/5fsi_8dg.sdf
    2607 2020-05-08 17:41 test/pdb_ligands_sdf/4hda_stl.sdf
    4958 2020-05-08 17:41 test/pdb_ligands_sdf/5ubr_85s.sdf
    5115 2020-05-08 17:41 test/pdb_ligands_sdf/1ygc_905.sdf
    2993 2020-05-08 17:41 test/pdb_ligands_sdf/4l0b_1ut.sdf
    2011 2020-05-08 17:41 test/pdb_ligands_sdf/3gzx_bnl.sdf
    5361 2020-05-08 17:41 test/pdb_ligands_sdf/1ywn_lif.sdf
    1704 2020-05-08 17:41 test/pdb_ligands_sdf/3tuw_pza.sdf
    4481 2020-05-08 17:41 test/pdb_ligands_sdf/1eld_0z0.sdf
    4260 2020-05-08 17:41 test/pdb_ligands_sdf/6euv_21g.sdf
    4006 2020-05-08 17:41 test/pdb_ligands_sdf/1f3f_d4t.sdf
    2749 2020-05-08 17:41 test/pdb_ligands_sdf/2evc_fc3.sdf
    3101 2020-05-08 17:41 test/pdb_ligands_sdf/4oxy_1tn.sdf
    1881 2020-05-08 17:41 test/pdb_ligands_sdf/1tfj_dka.sdf
    3585 2020-05-08 17:41 test/pdb_ligands_sdf/3jsx_cc2.sdf
    5602 2020-05-08 17:41 test/pdb_ligands_sdf/4drk_i63.sdf
    3139 2020-05-08 17:41 test/pdb_ligands_sdf/4i9n_1e5.sdf
    4530 2020-05-08 17:41 test/pdb_ligands_sdf/1wbt_wbt.sdf
    4622 2020-05-08 17:41 test/pdb_ligands_sdf/4nxo_2h7.sdf
    3672 2020-05-08 17:41 test/pdb_ligands_sdf/5d41_57n.sdf
    1874 2020-05-08 17:41 test/pdb_ligands_sdf/1gw9_lxc.sdf
    2075 2020-05-08 17:41 test/pdb_ligands_sdf/5cc6_4zv.sdf
    4120 2020-05-08 17:41 test/pdb_ligands_sdf/3w87_w87.sdf
    3923 2020-05-08 17:41 test/pdb_ligands_sdf/4rx8_3yx.sdf
    2322 2020-05-08 17:41 test/pdb_ligands_sdf/4m5a_da2.sdf
    4599 2020-05-08 17:41 test/pdb_ligands_sdf/4ftr_5hk.sdf
    3923 2020-05-08 17:41 test/pdb_ligands_sdf/3tib_lvo.sdf
    5891 2020-05-08 17:41 test/pdb_ligands_sdf/4kb9_g79.sdf
    4302 2020-05-08 17:41 test/pdb_ligands_sdf/2psj_cei.sdf
    3757 2020-05-08 17:41 test/pdb_ligands_sdf/3uol_0c7.sdf
    3388 2020-05-08 17:41 test/pdb_ligands_sdf/5cto_ntd.sdf
    6440 2020-05-08 17:41 test/pdb_ligands_sdf/1ai3_ndo.sdf
    3337 2020-05-08 17:41 test/pdb_ligands_sdf/5dgn_59y.sdf
    5956 2020-05-08 17:41 test/pdb_ligands_sdf/1gai_gac.sdf
    2553 2020-05-08 17:41 test/pdb_ligands_sdf/4ntm_2k8.sdf
    4198 2020-05-08 17:41 test/pdb_ligands_sdf/5caq_4zj.sdf
    4540 2020-05-08 17:41 test/pdb_ligands_sdf/2ogy_c2f.sdf
    4468 2020-05-08 17:41 test/pdb_ligands_sdf/5ens_rhq.sdf
    9440 2020-05-08 17:41 test/pdb_ligands_sdf/3och_2mx.sdf
    4117 2020-05-08 17:41 test/pdb_ligands_sdf/4hpj_1d0.sdf
    2333 2020-05-08 17:41 test/pdb_ligands_sdf/1m78_clz.sdf
    4460 2020-05-08 17:41 test/pdb_ligands_sdf/3b05_fnr.sdf
    4811 2020-05-08 17:41 test/pdb_ligands_sdf/3l9h_emq.sdf
    1838 2020-05-08 17:41 test/pdb_ligands_sdf/5ame_pw3.sdf
    3176 2020-05-08 17:41 test/pdb_ligands_sdf/5ceh_50p.sdf
    1784 2020-05-08 17:41 test/pdb_ligands_sdf/2dm5_odi.sdf
    3709 2020-05-08 17:41 test/pdb_ligands_sdf/2c3q_gtx.sdf
    2317 2020-05-08 17:41 test/pdb_ligands_sdf/5n6t_8p2.sdf
    2911 2020-05-08 17:41 test/pdb_ligands_sdf/4bu8_27f.sdf
    5009 2020-05-08 17:41 test/pdb_ligands_sdf/5lkz_coo.sdf
    3188 2020-05-08 17:41 test/pdb_ligands_sdf/2zoq_5id.sdf
    4270 2020-05-08 17:41 test/pdb_ligands_sdf/5t27_74f.sdf
    8106 2020-05-08 17:41 test/pdb_ligands_sdf/3sp7_03b.sdf
    4463 2020-05-08 17:41 test/pdb_ligands_sdf/4nk9_2k5.sdf
    3507 2020-05-08 17:41 test/pdb_ligands_sdf/5vvg_9pm.sdf
    3608 2020-05-08 17:41 test/pdb_ligands_sdf/3u2z_07t.sdf
    4815 2020-05-08 17:41 test/pdb_ligands_sdf/5mah_7kd.sdf
    5311 2020-05-08 17:41 test/pdb_ligands_sdf/2yak_osv.sdf
    3586 2020-05-08 17:41 test/pdb_ligands_sdf/3apw_dp0.sdf
    3214 2020-05-08 17:41 test/pdb_ligands_sdf/2xvq_9ds.sdf
    5644 2020-05-08 17:41 test/pdb_ligands_sdf/3e30_ed4.sdf
    3431 2020-05-08 17:41 test/pdb_ligands_sdf/3fnh_jpj.sdf
    4200 2020-05-08 17:41 test/pdb_ligands_sdf/4f4d_chd.sdf
    2452 2020-05-08 17:41 test/pdb_ligands_sdf/1u5c_bik.sdf
    8792 2020-05-08 17:41 test/pdb_ligands_sdf/1k2o_rfa.sdf
    5222 2020-05-08 17:41 test/pdb_ligands_sdf/3kmg_538.sdf
    4748 2020-05-08 17:41 test/pdb_ligands_sdf/5eyd_5t1.sdf
    3250 2020-05-08 17:41 test/pdb_ligands_sdf/4xrj_620.sdf
    3393 2020-05-08 17:41 test/pdb_ligands_sdf/2wp5_wp5.sdf
    3702 2020-05-08 17:41 test/pdb_ligands_sdf/4ncm_704.sdf
    3963 2020-05-08 17:41 test/pdb_ligands_sdf/2z60_p3y.sdf
    1997 2020-05-08 17:41 test/pdb_ligands_sdf/4cwd_449.sdf
    3615 2020-05-08 17:41 test/pdb_ligands_sdf/4rmi_3tk.sdf
    6249 2020-05-08 17:41 test/pdb_ligands_sdf/3ar7_tg1.sdf
    2290 2020-05-08 17:41 test/pdb_ligands_sdf/2pp3_lgt.sdf
    4071 2020-05-08 17:41 test/pdb_ligands_sdf/2byi_2dd.sdf
    3141 2020-05-08 17:41 test/pdb_ligands_sdf/4hmn_16j.sdf
    3495 2020-05-08 17:41 test/pdb_ligands_sdf/1q7a_opb.sdf
    3940 2020-05-08 17:41 test/pdb_ligands_sdf/2viv_vg2.sdf
    2514 2020-05-08 17:41 test/pdb_ligands_sdf/4um1_09p.sdf
    4094 2020-05-08 17:41 test/pdb_ligands_sdf/2g97_dgb.sdf
    5414 2020-05-08 17:41 test/pdb_ligands_sdf/5csx_54j.sdf
    3686 2020-05-08 17:41 test/pdb_ligands_sdf/2x90_eal.sdf
    3673 2020-05-08 17:41 test/pdb_ligands_sdf/3sww_kxb.sdf
    5624 2020-05-08 17:41 test/pdb_ligands_sdf/5svr_71c.sdf
    6154 2020-05-08 17:41 test/pdb_ligands_sdf/2i2d_a2d.sdf
    2443 2020-05-08 17:41 test/pdb_ligands_sdf/5a6n_u7e.sdf
    1692 2020-05-08 17:41 test/pdb_ligands_sdf/2vq5_hba.sdf
    3101 2020-05-08 17:41 test/pdb_ligands_sdf/1b9s_fdi.sdf
    5508 2020-05-08 17:41 test/pdb_ligands_sdf/5egm_5ny.sdf
    2987 2020-05-08 17:41 test/pdb_ligands_sdf/2rah_11p.sdf
    2343 2020-05-08 17:41 test/pdb_ligands_sdf/3k56_is3.sdf
    2988 2020-05-08 17:41 test/pdb_ligands_sdf/1li4_noc.sdf
    6059 2020-05-08 17:41 test/pdb_ligands_sdf/3fc2_ibi.sdf
    4498 2020-05-08 17:41 test/pdb_ligands_sdf/1gil_gsp.sdf
    4004 2020-05-08 17:41 test/pdb_ligands_sdf/4tqb_34k.sdf
    2173 2020-05-08 17:41 test/pdb_ligands_sdf/5ijr_hrg.sdf
    4805 2020-05-08 17:41 test/pdb_ligands_sdf/3ddw_055.sdf
    3669 2020-05-08 17:41 test/pdb_ligands_sdf/3fqe_p5c.sdf
    2440 2020-05-08 17:41 test/pdb_ligands_sdf/2r5n_rp5.sdf
    5536 2020-05-08 17:41 test/pdb_ligands_sdf/3ugc_046.sdf
    3877 2020-05-08 17:41 test/pdb_ligands_sdf/5ko1_6uy.sdf
    4901 2020-05-08 17:41 test/pdb_ligands_sdf/3f69_xdr.sdf
    3952 2020-05-08 17:41 test/pdb_ligands_sdf/1afq_0fg.sdf
    2998 2020-05-08 17:41 test/pdb_ligands_sdf/2uxi_g50.sdf
    3662 2020-05-08 17:41 test/pdb_ligands_sdf/4lko_1wh.sdf
    1948 2020-05-08 17:41 test/pdb_ligands_sdf/4ai8_dza.sdf
    5195 2020-05-08 17:41 test/pdb_ligands_sdf/4xkb_de9.sdf
    4966 2020-05-08 17:41 test/pdb_ligands_sdf/5l57_6n3.sdf
    2820 2020-05-08 17:41 test/pdb_ligands_sdf/2cc2_5ad.sdf
    2851 2020-05-08 17:41 test/pdb_ligands_sdf/1ht5_fl2.sdf
    3546 2020-05-08 17:41 test/pdb_ligands_sdf/4zg7_nkn.sdf
    3215 2020-05-08 17:41 test/pdb_ligands_sdf/5ha1_rne.sdf
    4706 2020-05-08 17:41 test/pdb_ligands_sdf/3tz3_b36.sdf
    4593 2020-05-08 17:41 test/pdb_ligands_sdf/4znv_4q7.sdf
    2114 2020-05-08 17:41 test/pdb_ligands_sdf/4n9s_8hx.sdf
    2696 2020-05-08 17:41 test/pdb_ligands_sdf/4f1q_0rz.sdf
    4448 2020-05-08 17:41 test/pdb_ligands_sdf/3kf4_b90.sdf
    1702 2020-05-08 17:41 test/pdb_ligands_sdf/1ldy_cxf.sdf
    7570 2020-05-08 17:41 test/pdb_ligands_sdf/4p9w_r3m.sdf
    3979 2020-05-08 17:41 test/pdb_ligands_sdf/5ita_6dc.sdf
    4062 2020-05-08 17:41 test/pdb_ligands_sdf/5tzw_7p4.sdf
    3594 2020-05-08 17:41 test/pdb_ligands_sdf/5kmj_6uf.sdf
    2919 2020-05-08 17:41 test/pdb_ligands_sdf/1y1d_fhi.sdf
    3606 2020-05-08 17:41 test/pdb_ligands_sdf/2ylq_ylq.sdf
    2156 2020-05-08 17:41 test/pdb_ligands_sdf/5kcp_pfb.sdf
    4599 2020-05-08 17:41 test/pdb_ligands_sdf/3w5e_nvw.sdf
    3373 2020-05-08 17:41 test/pdb_ligands_sdf/4yve_4kk.sdf
    6216 2020-05-08 17:41 test/pdb_ligands_sdf/3qgg_63f.sdf
    2994 2020-05-08 17:41 test/pdb_ligands_sdf/3t2d_p6f.sdf
    1825 2020-05-08 17:41 test/pdb_ligands_sdf/5cq4_53c.sdf
    3331 2020-05-08 17:41 test/pdb_ligands_sdf/5lz8_7bp.sdf
    3870 2020-05-08 17:41 test/pdb_ligands_sdf/4bwm_dct.sdf
    1945 2020-05-08 17:41 test/pdb_ligands_sdf/3r57_n3m.sdf
    3242 2020-05-08 17:41 test/pdb_ligands_sdf/4ciy_ndy.sdf
    4372 2020-05-08 17:41 test/pdb_ligands_sdf/4e47_0n6.sdf
    3862 2020-05-08 17:41 test/pdb_ligands_sdf/4xua_43c.sdf
    2674 2020-05-08 17:41 test/pdb_ligands_sdf/1ah0_sbi.sdf
    4800 2020-05-08 17:41 test/pdb_ligands_sdf/5bve_4vg.sdf
    1831 2020-05-08 17:41 test/pdb_ligands_sdf/9xim_xls.sdf
    3580 2020-05-08 17:41 test/pdb_ligands_sdf/5tvn_7ld.sdf
    3180 2020-05-08 17:41 test/pdb_ligands_sdf/3zyf_147.sdf
    4191 2020-05-08 17:41 test/pdb_ligands_sdf/5xr8_8d0.sdf
    7375 2020-05-08 17:41 test/pdb_ligands_sdf/3scu_ce5.sdf
    3165 2020-05-08 17:41 test/pdb_ligands_sdf/3u8f_fgm.sdf
    2026 2020-05-08 17:41 test/pdb_ligands_sdf/3qih_fg7.sdf
    4001 2020-05-08 17:41 test/pdb_ligands_sdf/3hl7_i47.sdf
    2642 2020-05-08 17:41 test/pdb_ligands_sdf/2bxa_c1f.sdf
    2093 2020-05-08 17:41 test/pdb_ligands_sdf/4n1o_lsa.sdf
    3192 2020-05-08 17:41 test/pdb_ligands_sdf/3geq_pp2.sdf
    4275 2020-05-08 17:41 test/pdb_ligands_sdf/4y46_4f2.sdf
    4964 2020-05-08 17:41 test/pdb_ligands_sdf/3efj_mt3.sdf
    3194 2020-05-08 17:41 test/pdb_ligands_sdf/2y00_y00.sdf
    2273 2020-05-08 17:41 test/pdb_ligands_sdf/4zuo_xs6.sdf
    4348 2020-05-08 17:41 test/pdb_ligands_sdf/4xv3_p02.sdf
    1729 2020-05-08 17:41 test/pdb_ligands_sdf/5h8m_lmr.sdf
    3731 2020-05-08 17:41 test/pdb_ligands_sdf/1yhy_1mm.sdf
    4707 2020-05-08 17:41 test/pdb_ligands_sdf/4bn5_sr7.sdf
    4751 2020-05-08 17:41 test/pdb_ligands_sdf/2g0h_sp3.sdf
    3806 2020-05-08 17:41 test/pdb_ligands_sdf/3ejr_hn4.sdf
    2212 2020-05-08 17:41 test/pdb_ligands_sdf/4kz8_1u6.sdf
    5453 2020-05-08 17:41 test/pdb_ligands_sdf/6bdm_y83.sdf
    1689 2020-05-08 17:41 test/pdb_ligands_sdf/5tbb_ppv.sdf
    4193 2020-05-08 17:41 test/pdb_ligands_sdf/4ylu_r30.sdf
    2562 2020-05-08 17:41 test/pdb_ligands_sdf/3o15_3nm.sdf
    4398 2020-05-08 17:41 test/pdb_ligands_sdf/4z93_4ld.sdf
    3225 2020-05-08 17:41 test/pdb_ligands_sdf/2e92_m0n.sdf
    3607 2020-05-08 17:41 test/pdb_ligands_sdf/2ot1_n3p.sdf
    2988 2020-05-08 17:41 test/pdb_ligands_sdf/3b9m_azz.sdf
    3557 2020-05-08 17:41 test/pdb_ligands_sdf/3kck_3kc.sdf
    2680 2020-05-08 17:41 test/pdb_ligands_sdf/3um5_cp6.sdf
    1880 2020-05-08 17:41 test/pdb_ligands_sdf/1eyw_ten.sdf
    5291 2020-05-08 17:41 test/pdb_ligands_sdf/1rbq_keu.sdf
    2980 2020-05-08 17:41 test/pdb_ligands_sdf/1al7_hst.sdf
    2536 2020-05-08 17:41 test/pdb_ligands_sdf/2vgc_v35.sdf
    3799 2020-05-08 17:41 test/pdb_ligands_sdf/2z9z_ddr.sdf
    2003 2020-05-08 17:41 test/pdb_ligands_sdf/5dr4_5gq.sdf
    3508 2020-05-08 17:41 test/pdb_ligands_sdf/3fr0_ajb.sdf
    4767 2020-05-08 17:41 test/pdb_ligands_sdf/5q19_9n1.sdf
    4013 2020-05-08 17:41 test/pdb_ligands_sdf/5uu1_7dz.sdf
    3540 2020-05-08 17:41 test/pdb_ligands_sdf/1dy3_87y.sdf
    4288 2020-05-08 17:41 test/pdb_ligands_sdf/2ole_kr2.sdf
    4894 2020-05-08 17:41 test/pdb_ligands_sdf/1jbw_acq.sdf
    4641 2020-05-08 17:41 test/pdb_ligands_sdf/3hc8_pd4.sdf
    2199 2020-05-08 17:41 test/pdb_ligands_sdf/5fsl_uan.sdf
    4548 2020-05-08 17:41 test/pdb_ligands_sdf/2d1o_fa4.sdf
    5776 2020-05-08 17:41 test/pdb_ligands_sdf/5mj6_7o2.sdf
    2401 2020-05-08 17:41 test/pdb_ligands_sdf/1jki_dg6.sdf
    2438 2020-05-08 17:41 test/pdb_ligands_sdf/2d3a_p3s.sdf
    3153 2020-05-08 17:41 test/pdb_ligands_sdf/2nnl_erd.sdf
    4891 2020-05-08 17:41 test/pdb_ligands_sdf/2zl9_vda.sdf
    3406 2020-05-08 17:41 test/pdb_ligands_sdf/1g9s_imp.sdf
    4390 2020-05-08 17:41 test/pdb_ligands_sdf/4ebd_0oj.sdf
    4012 2020-05-08 17:41 test/pdb_ligands_sdf/4o33_tzn.sdf
    1618 2020-05-08 17:41 test/pdb_ligands_sdf/4iqi_cyt.sdf
    2307 2020-05-08 17:41 test/pdb_ligands_sdf/5fsm_n91.sdf
    3856 2020-05-08 17:41 test/pdb_ligands_sdf/5kb3_4ct.sdf
    2322 2020-05-08 17:41 test/pdb_ligands_sdf/4c2p_x8z.sdf
    2890 2020-05-08 17:41 test/pdb_ligands_sdf/5eqp_5r9.sdf
    1240 2020-05-08 17:41 test/pdb_ligands_sdf/2nmv_nml.sdf
    3822 2020-05-08 17:41 test/pdb_ligands_sdf/2ggb_u17.sdf
    3183 2020-05-08 17:41 test/pdb_ligands_sdf/2sli_skd.sdf
    5321 2020-05-08 17:41 test/pdb_ligands_sdf/4jyt_n4a.sdf
    1813 2020-05-08 17:41 test/pdb_ligands_sdf/2vce_tc7.sdf
    1361 2020-05-08 17:41 test/pdb_ligands_sdf/1dmj_itu.sdf
    5122 2020-05-08 17:41 test/pdb_ligands_sdf/4elv_0r7.sdf
    2093 2020-05-08 17:41 test/pdb_ligands_sdf/5fe6_5wz.sdf
    4829 2020-05-08 17:41 test/pdb_ligands_sdf/4na9_1t7.sdf
    5232 2020-05-08 17:41 test/pdb_ligands_sdf/3cui_x4s.sdf
    3416 2020-05-08 17:41 test/pdb_ligands_sdf/3mjx_bit.sdf
    2078 2020-05-08 17:41 test/pdb_ligands_sdf/3dtu_trd.sdf
    3877 2020-05-08 17:41 test/pdb_ligands_sdf/4pkv_30r.sdf
    3323 2020-05-08 17:41 test/pdb_ligands_sdf/3fv1_dyh.sdf
    3857 2020-05-08 17:41 test/pdb_ligands_sdf/3kaf_4d9.sdf
    5376 2020-05-08 17:41 test/pdb_ligands_sdf/3lik_eeg.sdf
    4486 2020-05-08 17:41 test/pdb_ligands_sdf/4tvj_09l.sdf
    2846 2020-05-08 17:41 test/pdb_ligands_sdf/1ubw_gpp.sdf
    2551 2020-05-08 17:41 test/pdb_ligands_sdf/4y2j_49g.sdf
    1589 2020-05-08 17:41 test/pdb_ligands_sdf/4wpl_ura.sdf
    3439 2020-05-08 17:41 test/pdb_ligands_sdf/1e98_atm.sdf
    4592 2020-05-08 17:41 test/pdb_ligands_sdf/4cjs_l0y.sdf
    5160 2020-05-08 17:41 test/pdb_ligands_sdf/3zs4_1pr.sdf
    8009 2020-05-08 17:41 test/pdb_ligands_sdf/1qbt_146.sdf
    2908 2020-05-08 17:41 test/pdb_ligands_sdf/4ie6_un9.sdf
    2472 2020-05-08 17:41 test/pdb_ligands_sdf/2p8o_bva.sdf
    3172 2020-05-08 17:41 test/pdb_ligands_sdf/6bk3_b2s.sdf
    4379 2020-05-08 17:41 test/pdb_ligands_sdf/1dyh_dzf.sdf
    5217 2020-05-08 17:41 test/pdb_ligands_sdf/3mo5_e72.sdf
    4005 2020-05-08 17:41 test/pdb_ligands_sdf/3ei6_pl4.sdf
    2506 2020-05-08 17:41 test/pdb_ligands_sdf/5c7b_4yd.sdf
    4929 2020-05-08 17:41 test/pdb_ligands_sdf/3eu5_gbo.sdf
    2324 2020-05-08 17:41 test/pdb_ligands_sdf/4di8_0gy.sdf
    4025 2020-05-08 17:41 test/pdb_ligands_sdf/1owi_426.sdf
    3024 2020-05-08 17:41 test/pdb_ligands_sdf/4ci3_y70.sdf
    2151 2020-05-08 17:41 test/pdb_ligands_sdf/5fyy_n6y.sdf
    4305 2020-05-08 17:41 test/pdb_ligands_sdf/4ago_p74.sdf
    4074 2020-05-08 17:41 test/pdb_ligands_sdf/5xgn_85x.sdf
    1509 2020-05-08 17:41 test/pdb_ligands_sdf/2ha7_etm.sdf
   11025 2020-05-08 17:41 test/pdb_ligands_sdf/4eb9_0o6.sdf
    3569 2020-05-08 17:41 test/pdb_ligands_sdf/4jew_p00.sdf
    4453 2020-05-08 17:41 test/pdb_ligands_sdf/4g0v_mix.sdf
    5371 2020-05-08 17:41 test/pdb_ligands_sdf/5one_9yq.sdf
    3382 2020-05-08 17:41 test/pdb_ligands_sdf/5lla_6yq.sdf
    3996 2020-05-08 17:41 test/pdb_ligands_sdf/1pwu_gm6.sdf
    2182 2020-05-08 17:41 test/pdb_ligands_sdf/1e2m_hpt.sdf
    2224 2020-05-08 17:41 test/pdb_ligands_sdf/5erm_210.sdf
    3709 2020-05-08 17:41 test/pdb_ligands_sdf/5anu_58t.sdf
    3248 2020-05-08 17:41 test/pdb_ligands_sdf/1pzo_cbt.sdf
    3035 2020-05-08 17:41 test/pdb_ligands_sdf/2waj_snb.sdf
    1965 2020-05-08 17:41 test/pdb_ligands_sdf/2ihv_gva.sdf
    4237 2020-05-08 17:41 test/pdb_ligands_sdf/5bnj_4tv.sdf
    2282 2020-05-08 17:41 test/pdb_ligands_sdf/5jdg_mys.sdf
    4904 2020-05-08 17:41 test/pdb_ligands_sdf/3zcm_px3.sdf
    3768 2020-05-08 17:41 test/pdb_ligands_sdf/3rx2_slo.sdf
    2633 2020-05-08 17:41 test/pdb_ligands_sdf/1ek1_ciu.sdf
    2087 2020-05-08 17:41 test/pdb_ligands_sdf/3gch_oac.sdf
    3405 2020-05-08 17:41 test/pdb_ligands_sdf/1s0m_bap.sdf
    4110 2020-05-08 17:41 test/pdb_ligands_sdf/1udu_cia.sdf
    4741 2020-05-08 17:41 test/pdb_ligands_sdf/1y3w_uip.sdf
    4468 2020-05-08 17:41 test/pdb_ligands_sdf/5tw3_7n1.sdf
    4338 2020-05-08 17:41 test/pdb_ligands_sdf/1iqm_xmk.sdf
    6982 2020-05-08 17:41 test/pdb_ligands_sdf/3hxf_bd9.sdf
    2105 2020-05-08 17:41 test/pdb_ligands_sdf/3n7a_fa1.sdf
    4665 2020-05-08 17:41 test/pdb_ligands_sdf/4ztr_4rj.sdf
    3933 2020-05-08 17:41 test/pdb_ligands_sdf/4jpc_1m6.sdf
    3151 2020-05-08 17:41 test/pdb_ligands_sdf/8cho_p4c.sdf
    4235 2020-05-08 17:41 test/pdb_ligands_sdf/3i0r_rt3.sdf
    3972 2020-05-08 17:41 test/pdb_ligands_sdf/2f2k_tgg.sdf
    3302 2020-05-08 17:41 test/pdb_ligands_sdf/5k0g_6pm.sdf
    4344 2020-05-08 17:41 test/pdb_ligands_sdf/1o79_r23.sdf
    3934 2020-05-08 17:41 test/pdb_ligands_sdf/3udy_09g.sdf
    5576 2020-05-08 17:41 test/pdb_ligands_sdf/1bb7_gum.sdf
    1705 2020-05-08 17:41 test/pdb_ligands_sdf/1hld_brb.sdf
    3800 2020-05-08 17:41 test/pdb_ligands_sdf/4v0i_j82.sdf
    2354 2020-05-08 17:41 test/pdb_ligands_sdf/4jwx_1n4.sdf
    5519 2020-05-08 17:41 test/pdb_ligands_sdf/4okg_2sz.sdf
    4526 2020-05-08 17:41 test/pdb_ligands_sdf/4d3t_rfq.sdf
    3066 2020-05-08 17:41 test/pdb_ligands_sdf/4oqm_fdu.sdf
    6602 2020-05-08 17:41 test/pdb_ligands_sdf/4mcq_29c.sdf
    6045 2020-05-08 17:41 test/pdb_ligands_sdf/3g6h_g6h.sdf
    3933 2020-05-08 17:41 test/pdb_ligands_sdf/5fi4_5xv.sdf
    3005 2020-05-08 17:41 test/pdb_ligands_sdf/3ddf_gb6.sdf
    4162 2020-05-08 17:41 test/pdb_ligands_sdf/5ut2_3yt.sdf
    3630 2020-05-08 17:41 test/pdb_ligands_sdf/2bml_xed.sdf
    6043 2020-05-08 17:41 test/pdb_ligands_sdf/3oz1_bmb.sdf
    3148 2020-05-08 17:41 test/pdb_ligands_sdf/1y2k_7de.sdf
    2576 2020-05-08 17:41 test/pdb_ligands_sdf/2wc5_bom.sdf
    2502 2020-05-08 17:41 test/pdb_ligands_sdf/1fhv_osb.sdf
    4372 2020-05-08 17:41 test/pdb_ligands_sdf/5mw8_5my.sdf
    2199 2020-05-08 17:41 test/pdb_ligands_sdf/4r6n_mbg.sdf
    4004 2020-05-08 17:41 test/pdb_ligands_sdf/2ort_342.sdf
    4414 2020-05-08 17:41 test/pdb_ligands_sdf/1tfz_869.sdf
    3407 2020-05-08 17:41 test/pdb_ligands_sdf/4ptg_2wg.sdf
    3594 2020-05-08 17:41 test/pdb_ligands_sdf/3g4f_fpf.sdf
    5003 2020-05-08 17:41 test/pdb_ligands_sdf/1mq6_xld.sdf
    3074 2020-05-08 17:41 test/pdb_ligands_sdf/3fvn_9dx.sdf
    4300 2020-05-08 17:41 test/pdb_ligands_sdf/5ja3_u06.sdf
    3147 2020-05-08 17:41 test/pdb_ligands_sdf/5lgr_qvr.sdf
    4751 2020-05-08 17:41 test/pdb_ligands_sdf/3mvr_cm5.sdf
    3341 2020-05-08 17:41 test/pdb_ligands_sdf/1zp5_2ni.sdf
    2739 2020-05-08 17:41 test/pdb_ligands_sdf/4nra_2lw.sdf
    4538 2020-05-08 17:41 test/pdb_ligands_sdf/3oya_rlt.sdf
    4459 2020-05-08 17:41 test/pdb_ligands_sdf/4b8l_a0p.sdf
    4817 2020-05-08 17:41 test/pdb_ligands_sdf/4xv2_p06.sdf
    1724 2020-05-08 17:41 test/pdb_ligands_sdf/5kts_ciz.sdf
    1718 2020-05-08 17:41 test/pdb_ligands_sdf/4mnw_zbr.sdf
    2938 2020-05-08 17:41 test/pdb_ligands_sdf/5myn_zuf.sdf
    3751 2020-05-08 17:41 test/pdb_ligands_sdf/5jo3_6lk.sdf
    3872 2020-05-08 17:41 test/pdb_ligands_sdf/3oq1_3oq.sdf
    1145 2020-05-08 17:41 test/pdb_ligands_sdf/3msx_mgf.sdf
    1682 2020-05-08 17:41 test/pdb_ligands_sdf/3kqv_fan.sdf
    1954 2020-05-08 17:41 test/pdb_ligands_sdf/4own_5rg.sdf
    4166 2020-05-08 17:41 test/pdb_ligands_sdf/4ci4_y1n.sdf
    1944 2020-05-08 17:41 test/pdb_ligands_sdf/1mdl_smn.sdf
    4829 2020-05-08 17:41 test/pdb_ligands_sdf/1j1a_bhp.sdf
    4700 2020-05-08 17:41 test/pdb_ligands_sdf/4h3i_10v.sdf
    1471 2020-05-08 17:41 test/pdb_ligands_sdf/4mv7_ppf.sdf
    3986 2020-05-08 17:41 test/pdb_ligands_sdf/4z1f_h71.sdf
    2459 2020-05-08 17:41 test/pdb_ligands_sdf/4yqr_4hq.sdf
    4294 2020-05-08 17:41 test/pdb_ligands_sdf/3uli_1n3.sdf
    3806 2020-05-08 17:41 test/pdb_ligands_sdf/3dz7_o8m.sdf
    2743 2020-05-08 17:41 test/pdb_ligands_sdf/1ot3_thm.sdf
    4606 2020-05-08 17:41 test/pdb_ligands_sdf/4yjv_4dt.sdf
    3670 2020-05-08 17:41 test/pdb_ligands_sdf/3nf8_cdq.sdf
    3238 2020-05-08 17:41 test/pdb_ligands_sdf/1ohs_5sd.sdf
    3852 2020-05-08 17:41 test/pdb_ligands_sdf/5tq3_7gz.sdf
    7049 2020-05-08 17:41 test/pdb_ligands_sdf/2p41_g1g.sdf
    3304 2020-05-08 17:41 test/pdb_ligands_sdf/1og5_swf.sdf
    4077 2020-05-08 17:41 test/pdb_ligands_sdf/2vgo_ad5.sdf
    1850 2020-05-08 17:41 test/pdb_ligands_sdf/3lyi_ocs.sdf
    5490 2020-05-08 17:41 test/pdb_ligands_sdf/3zk6_h1i.sdf
    3031 2020-05-08 17:41 test/pdb_ligands_sdf/4pyl_tcw.sdf
    2229 2020-05-08 17:41 test/pdb_ligands_sdf/5hwe_mha.sdf
    4430 2020-05-08 17:41 test/pdb_ligands_sdf/1nrl_srl.sdf
    4040 2020-05-08 17:41 test/pdb_ligands_sdf/4y9e_mkt.sdf
    3175 2020-05-08 17:41 test/pdb_ligands_sdf/4aj4_vab.sdf
    4252 2020-05-08 17:41 test/pdb_ligands_sdf/4gs8_mgj.sdf
    4210 2020-05-08 17:41 test/pdb_ligands_sdf/1qss_dg3.sdf
    3631 2020-05-08 17:41 test/pdb_ligands_sdf/4fue_7up.sdf
    3831 2020-05-08 17:41 test/pdb_ligands_sdf/3gmd_2m3.sdf
    5294 2020-05-08 17:41 test/pdb_ligands_sdf/4er0_aw1.sdf
    2102 2020-05-08 17:41 test/pdb_ligands_sdf/3phj_dhk.sdf
    2184 2020-05-08 17:41 test/pdb_ligands_sdf/4cr9_otw.sdf
    5126 2020-05-08 17:41 test/pdb_ligands_sdf/5q18_9my.sdf
    3415 2020-05-08 17:41 test/pdb_ligands_sdf/4mwx_zmr.sdf
    4268 2020-05-08 17:41 test/pdb_ligands_sdf/3ua8_08w.sdf
    2048 2020-05-08 17:41 test/pdb_ligands_sdf/3eyk_eyk.sdf
    4890 2020-05-08 17:41 test/pdb_ligands_sdf/3iop_8i1.sdf
    3054 2020-05-08 17:41 test/pdb_ligands_sdf/4bar_ikx.sdf
    3583 2020-05-08 17:41 test/pdb_ligands_sdf/4ky2_1w3.sdf
    1720 2020-05-08 17:41 test/pdb_ligands_sdf/5f8x_mrz.sdf
    2242 2020-05-08 17:41 test/pdb_ligands_sdf/4g5f_15n.sdf
    2201 2020-05-08 17:41 test/pdb_ligands_sdf/4bi2_zo8.sdf
    3495 2020-05-08 17:41 test/pdb_ligands_sdf/2pbw_doq.sdf
    4466 2020-05-08 17:41 test/pdb_ligands_sdf/4bfv_zvv.sdf
    3509 2020-05-08 17:41 test/pdb_ligands_sdf/4b6q_bz5.sdf
    4302 2020-05-08 17:41 test/pdb_ligands_sdf/3wlu_lse.sdf
    3493 2020-05-08 17:41 test/pdb_ligands_sdf/4gj5_0lr.sdf
    1939 2020-05-08 17:41 test/pdb_ligands_sdf/2ay7_clt.sdf
    2583 2020-05-08 17:41 test/pdb_ligands_sdf/2i7d_dur.sdf
    4095 2020-05-08 17:41 test/pdb_ligands_sdf/4ehg_ri9.sdf
    8171 2020-05-08 17:41 test/pdb_ligands_sdf/4mpu_x2a.sdf
    2910 2020-05-08 17:41 test/pdb_ligands_sdf/1y2h_6de.sdf
    3259 2020-05-08 17:41 test/pdb_ligands_sdf/5g4o_o80.sdf
    3639 2020-05-08 17:41 test/pdb_ligands_sdf/4dmn_0l9.sdf
    4488 2020-05-08 17:41 test/pdb_ligands_sdf/2opy_co9.sdf
    3638 2020-05-08 17:41 test/pdb_ligands_sdf/1q4l_679.sdf
    4902 2020-05-08 17:41 test/pdb_ligands_sdf/5nu1_8yb.sdf
    3944 2020-05-08 17:41 test/pdb_ligands_sdf/4zqn_4qo.sdf
    3565 2020-05-08 17:41 test/pdb_ligands_sdf/2w09_cm9.sdf
    3710 2020-05-08 17:41 test/pdb_ligands_sdf/1bzy_imu.sdf
    4659 2020-05-08 17:41 test/pdb_ligands_sdf/1d9i_00p.sdf
    5031 2020-05-08 17:41 test/pdb_ligands_sdf/2oiq_sti.sdf
    5816 2020-05-08 17:41 test/pdb_ligands_sdf/4blj_70b.sdf
    1817 2020-05-08 17:41 test/pdb_ligands_sdf/3q5s_ach.sdf
    3530 2020-05-08 17:41 test/pdb_ligands_sdf/3goi_loi.sdf
    4211 2020-05-08 17:41 test/pdb_ligands_sdf/1tsm_mr2.sdf
    2049 2020-05-08 17:41 test/pdb_ligands_sdf/1dzk_prz.sdf
    2560 2020-05-08 17:41 test/pdb_ligands_sdf/2gg3_u13.sdf
    3929 2020-05-08 17:41 test/pdb_ligands_sdf/5p9d_77r.sdf
    4208 2020-05-08 17:41 test/pdb_ligands_sdf/1r20_hwg.sdf
    2955 2020-05-08 17:41 test/pdb_ligands_sdf/1add_1da.sdf
    4210 2020-05-08 17:41 test/pdb_ligands_sdf/4wlk_3ql.sdf
    3930 2020-05-08 17:41 test/pdb_ligands_sdf/4gcq_0jm.sdf
    4447 2020-05-08 17:41 test/pdb_ligands_sdf/5tto_7kk.sdf
    2888 2020-05-08 17:41 test/pdb_ligands_sdf/4yqn_4h3.sdf
    4969 2020-05-08 17:41 test/pdb_ligands_sdf/4occ_2tz.sdf
    2955 2020-05-08 17:41 test/pdb_ligands_sdf/1n9a_hfp.sdf
    2692 2020-05-08 17:41 test/pdb_ligands_sdf/3wh0_o4b.sdf
    9311 2020-05-08 17:41 test/pdb_ligands_sdf/5jsm_6nb.sdf
    3893 2020-05-08 17:41 test/pdb_ligands_sdf/5lv2_sao.sdf
    2321 2020-05-08 17:41 test/pdb_ligands_sdf/3utc_0jx.sdf
    5532 2020-05-08 17:41 test/pdb_ligands_sdf/5ea5_tm3.sdf
    2965 2020-05-08 17:41 test/pdb_ligands_sdf/5ktu_6xb.sdf
    3805 2020-05-08 17:41 test/pdb_ligands_sdf/4eyj_n61.sdf
    2125 2020-05-08 17:41 test/pdb_ligands_sdf/5d2t_6vp.sdf
    5584 2020-05-08 17:41 test/pdb_ligands_sdf/1wtg_3bp.sdf
    3122 2020-05-08 17:41 test/pdb_ligands_sdf/4d43_9w7.sdf
    4568 2020-05-08 17:41 test/pdb_ligands_sdf/4oc5_2qm.sdf
    2505 2020-05-08 17:41 test/pdb_ligands_sdf/1mqh_bwd.sdf
    4929 2020-05-08 17:41 test/pdb_ligands_sdf/5wqh_7wx.sdf
    3982 2020-05-08 17:41 test/pdb_ligands_sdf/5mtq_xt3.sdf
    5954 2020-05-08 17:41 test/pdb_ligands_sdf/2aa3_ap0.sdf
    3488 2020-05-08 17:41 test/pdb_ligands_sdf/4aw0_mjf.sdf
    3577 2020-05-08 17:41 test/pdb_ligands_sdf/4x2u_tod.sdf
    4290 2020-05-08 17:41 test/pdb_ligands_sdf/5bpc_f2a.sdf
    4870 2020-05-08 17:41 test/pdb_ligands_sdf/4crd_otj.sdf
    1437 2020-05-08 17:41 test/pdb_ligands_sdf/3gky_iph.sdf
    3976 2020-05-08 17:41 test/pdb_ligands_sdf/4x86_cps.sdf
    3771 2020-05-08 17:41 test/pdb_ligands_sdf/4rme_3t2.sdf
    2778 2020-05-08 17:41 test/pdb_ligands_sdf/4qc0_xg1.sdf
    3417 2020-05-08 17:41 test/pdb_ligands_sdf/1zua_tol.sdf
    3844 2020-05-08 17:41 test/pdb_ligands_sdf/4wiv_3p2.sdf
    4655 2020-05-08 17:41 test/pdb_ligands_sdf/5k0k_6q1.sdf
    4428 2020-05-08 17:41 test/pdb_ligands_sdf/3wym_3k9.sdf
    4111 2020-05-08 17:41 test/pdb_ligands_sdf/2dq0_ssa.sdf
    3852 2020-05-08 17:41 test/pdb_ligands_sdf/4md6_24e.sdf
    3740 2020-05-08 17:41 test/pdb_ligands_sdf/3nfb_oae.sdf
    4727 2020-05-08 17:41 test/pdb_ligands_sdf/2y66_n04.sdf
    5040 2020-05-08 17:41 test/pdb_ligands_sdf/5vqq_9jp.sdf
    2524 2020-05-08 17:41 test/pdb_ligands_sdf/2agv_bhq.sdf
    2844 2020-05-08 17:41 test/pdb_ligands_sdf/3s3g_tlt.sdf
    3707 2020-05-08 17:41 test/pdb_ligands_sdf/4q8s_pnr.sdf
    2404 2020-05-08 17:41 test/pdb_ligands_sdf/4i8x_6p3.sdf
    4582 2020-05-08 17:41 test/pdb_ligands_sdf/3wig_chu.sdf
    3247 2020-05-08 17:41 test/pdb_ligands_sdf/5g6h_m85.sdf
    3233 2020-05-08 17:41 test/pdb_ligands_sdf/3ey4_352.sdf
    2317 2020-05-08 17:41 test/pdb_ligands_sdf/5f1j_5to.sdf
    3501 2020-05-08 17:41 test/pdb_ligands_sdf/3bpr_olp.sdf
    2973 2020-05-08 17:41 test/pdb_ligands_sdf/5p9v_7jm.sdf
    5163 2020-05-08 17:41 test/pdb_ligands_sdf/3ekn_gs3.sdf
    2095 2020-05-08 17:41 test/pdb_ligands_sdf/4q2x_ggb.sdf
    3110 2020-05-08 17:41 test/pdb_ligands_sdf/4xue_43j.sdf
    3389 2020-05-08 17:41 test/pdb_ligands_sdf/3sec_pfu.sdf
    5287 2020-05-08 17:41 test/pdb_ligands_sdf/3fxv_643.sdf
    3849 2020-05-08 17:41 test/pdb_ligands_sdf/1kvl_cls.sdf
    2670 2020-05-08 17:41 test/pdb_ligands_sdf/1duv_psq.sdf
    3143 2020-05-08 17:41 test/pdb_ligands_sdf/5u4e_xlb.sdf
    4455 2020-05-08 17:41 test/pdb_ligands_sdf/3zep_1nx.sdf
    4193 2020-05-08 17:41 test/pdb_ligands_sdf/3l0l_hc3.sdf
    3875 2020-05-08 17:41 test/pdb_ligands_sdf/4ubt_3g6.sdf
    4148 2020-05-08 17:41 test/pdb_ligands_sdf/1bxm_erg.sdf
    1965 2020-05-08 17:41 test/pdb_ligands_sdf/5cga_kp6.sdf
    4449 2020-05-08 17:41 test/pdb_ligands_sdf/2i5c_ip5.sdf
    1936 2020-05-08 17:41 test/pdb_ligands_sdf/1ez2_dii.sdf
    3635 2020-05-08 17:41 test/pdb_ligands_sdf/4l70_1v9.sdf
    3485 2020-05-08 17:41 test/pdb_ligands_sdf/4eq1_pe5.sdf
    1372 2020-05-08 17:41 test/pdb_ligands_sdf/4jnk_lac.sdf
    2908 2020-05-08 17:41 test/pdb_ligands_sdf/4uvn_cdj.sdf
    5496 2020-05-08 17:41 test/pdb_ligands_sdf/2h59_3od.sdf
    3336 2020-05-08 17:41 test/pdb_ligands_sdf/3mke_cb4.sdf
    3110 2020-05-08 17:41 test/pdb_ligands_sdf/4l6q_1wu.sdf
    3155 2020-05-08 17:41 test/pdb_ligands_sdf/3ack_ksr.sdf
    3307 2020-05-08 17:41 test/pdb_ligands_sdf/4itx_in5.sdf
    4977 2020-05-08 17:41 test/pdb_ligands_sdf/3tz9_aqu.sdf
    3238 2020-05-08 17:41 test/pdb_ligands_sdf/5h85_5xs.sdf
    5115 2020-05-08 17:41 test/pdb_ligands_sdf/5mar_ar6.sdf
    2769 2020-05-08 17:41 test/pdb_ligands_sdf/1ftl_dnq.sdf
    2201 2020-05-08 17:41 test/pdb_ligands_sdf/2akw_200.sdf
    5013 2020-05-08 17:41 test/pdb_ligands_sdf/3q4b_rx5.sdf
    4918 2020-05-08 17:41 test/pdb_ligands_sdf/4g9c_0wp.sdf
    4648 2020-05-08 17:41 test/pdb_ligands_sdf/3q3d_puy.sdf
    2777 2020-05-08 17:41 test/pdb_ligands_sdf/3rme_rme.sdf
    4724 2020-05-08 17:41 test/pdb_ligands_sdf/5ad2_etu.sdf
    5040 2020-05-08 17:41 test/pdb_ligands_sdf/1i6k_tym.sdf
    9007 2020-05-08 17:41 test/pdb_ligands_sdf/4uvc_d52.sdf
    4302 2020-05-08 17:41 test/pdb_ligands_sdf/5oxg_b4b.sdf
    3295 2020-05-08 17:41 test/pdb_ligands_sdf/1lw2_u05.sdf
    3951 2020-05-08 17:41 test/pdb_ligands_sdf/1db5_6in.sdf
    5186 2020-05-08 17:41 test/pdb_ligands_sdf/5h0e_oos.sdf
    2752 2020-05-08 17:41 test/pdb_ligands_sdf/3nsq_chz.sdf
    2684 2020-05-08 17:41 test/pdb_ligands_sdf/1p6m_dp3.sdf
    2098 2020-05-08 17:41 test/pdb_ligands_sdf/4u71_q03.sdf
    3454 2020-05-08 17:41 test/pdb_ligands_sdf/2c3i_iyz.sdf
    1575 2020-05-08 17:41 test/pdb_ligands_sdf/2cgo_fum.sdf
    3344 2020-05-08 17:41 test/pdb_ligands_sdf/4oxk_1s5.sdf
    3007 2020-05-08 17:41 test/pdb_ligands_sdf/3e12_kd0.sdf
    4229 2020-05-08 17:41 test/pdb_ligands_sdf/4e90_7rg.sdf
    2349 2020-05-08 17:41 test/pdb_ligands_sdf/1wb5_syr.sdf
    2714 2020-05-08 17:41 test/pdb_ligands_sdf/5mhb_pbg.sdf
    2330 2020-05-08 17:41 test/pdb_ligands_sdf/1xxs_ste.sdf
    4524 2020-05-08 17:41 test/pdb_ligands_sdf/4yjs_4dn.sdf
    3006 2020-05-08 17:41 test/pdb_ligands_sdf/3ggs_2fd.sdf
    4879 2020-05-08 17:41 test/pdb_ligands_sdf/3q3t_rx0.sdf
    4975 2020-05-08 17:41 test/pdb_ligands_sdf/3ty0_082.sdf
    2123 2020-05-08 17:41 test/pdb_ligands_sdf/5wk7_cah.sdf
    2788 2020-05-08 17:41 test/pdb_ligands_sdf/5ut3_ik1.sdf
    5345 2020-05-08 17:41 test/pdb_ligands_sdf/3npr_ps7.sdf
    2309 2020-05-08 17:41 test/pdb_ligands_sdf/4zi4_dvg.sdf
    1830 2020-05-08 17:41 test/pdb_ligands_sdf/4qdw_lai.sdf
    2953 2020-05-08 17:41 test/pdb_ligands_sdf/1gi8_bmz.sdf
    3813 2020-05-08 17:41 test/pdb_ligands_sdf/3fsk_ro6.sdf
    2060 2020-05-08 17:41 test/pdb_ligands_sdf/2is7_2cl.sdf
    4132 2020-05-08 17:41 test/pdb_ligands_sdf/2xk9_xk9.sdf
    3956 2020-05-08 17:41 test/pdb_ligands_sdf/4pnk_kzq.sdf
    3021 2020-05-08 17:41 test/pdb_ligands_sdf/3vzc_uul.sdf
    4807 2020-05-08 17:41 test/pdb_ligands_sdf/3vv0_kh3.sdf
    4631 2020-05-08 17:41 test/pdb_ligands_sdf/3q5r_kan.sdf
    6066 2020-05-08 17:41 test/pdb_ligands_sdf/4gr3_r45.sdf
    5120 2020-05-08 17:41 test/pdb_ligands_sdf/3eyl_smk.sdf
    2694 2020-05-08 17:41 test/pdb_ligands_sdf/1ycl_kri.sdf
    5363 2020-05-08 17:41 test/pdb_ligands_sdf/3t9e_i7p.sdf
    5365 2020-05-08 17:41 test/pdb_ligands_sdf/4eki_0qk.sdf
    4422 2020-05-08 17:41 test/pdb_ligands_sdf/3qup_lun.sdf
    4685 2020-05-08 17:41 test/pdb_ligands_sdf/1j17_zen.sdf
    4823 2020-05-08 17:41 test/pdb_ligands_sdf/1hpv_478.sdf
    3253 2020-05-08 17:41 test/pdb_ligands_sdf/4m0y_m0y.sdf
    3448 2020-05-08 17:41 test/pdb_ligands_sdf/5x30_7xf.sdf
    2524 2020-05-08 17:41 test/pdb_ligands_sdf/5mgm_7mz.sdf
    2053 2020-05-08 17:41 test/pdb_ligands_sdf/4oj8_2tq.sdf
    2101 2020-05-08 17:41 test/pdb_ligands_sdf/4pr8_urc.sdf
    5579 2020-05-08 17:41 test/pdb_ligands_sdf/4j03_fvs.sdf
    4196 2020-05-08 17:41 test/pdb_ligands_sdf/4b0g_vek.sdf
    5338 2020-05-08 17:41 test/pdb_ligands_sdf/5tjn_bgb.sdf
    4943 2020-05-08 17:41 test/pdb_ligands_sdf/5kot_6vu.sdf
    3078 2020-05-08 17:41 test/pdb_ligands_sdf/3gus_n11.sdf
    3028 2020-05-08 17:41 test/pdb_ligands_sdf/4ui5_bj4.sdf
    2295 2020-05-08 17:41 test/pdb_ligands_sdf/1o4q_256.sdf
    5346 2020-05-08 17:41 test/pdb_ligands_sdf/3v66_d3a.sdf
    3244 2020-05-08 17:41 test/pdb_ligands_sdf/5tcj_79v.sdf
    4035 2020-05-08 17:41 test/pdb_ligands_sdf/5xra_8d3.sdf
    8041 2020-05-08 17:41 test/pdb_ligands_sdf/2by4_ad4.sdf
    3045 2020-05-08 17:41 test/pdb_ligands_sdf/2esm_m77.sdf
    2979 2020-05-08 17:41 test/pdb_ligands_sdf/1gi7_120.sdf
    4281 2020-05-08 17:41 test/pdb_ligands_sdf/4fti_h7k.sdf
    4595 2020-05-08 17:41 test/pdb_ligands_sdf/5nk5_90k.sdf
    3137 2020-05-08 17:41 test/pdb_ligands_sdf/1jjb_pe7.sdf
    1805 2020-05-08 17:41 test/pdb_ligands_sdf/1gx2_bho.sdf
    5384 2020-05-08 17:41 test/pdb_ligands_sdf/4zhc_tc2.sdf
    3021 2020-05-08 17:41 test/pdb_ligands_sdf/2j7e_gi2.sdf
    3029 2020-05-08 17:41 test/pdb_ligands_sdf/1gzq_twt.sdf
    4336 2020-05-08 17:41 test/pdb_ligands_sdf/5fd2_5xj.sdf
    4600 2020-05-08 17:41 test/pdb_ligands_sdf/4lpb_1yp.sdf
    3799 2020-05-08 17:41 test/pdb_ligands_sdf/3sgt_p09.sdf
    3927 2020-05-08 17:41 test/pdb_ligands_sdf/2qyk_npv.sdf
    6463 2020-05-08 17:41 test/pdb_ligands_sdf/4oni_p6l.sdf
    4346 2020-05-08 17:41 test/pdb_ligands_sdf/4wet_wef.sdf
    2234 2020-05-08 17:41 test/pdb_ligands_sdf/1pq3_s2c.sdf
    1823 2020-05-08 17:41 test/pdb_ligands_sdf/3fue_11s.sdf
    7219 2020-05-08 17:41 test/pdb_ligands_sdf/1e9a_z5a.sdf
    3599 2020-05-08 17:41 test/pdb_ligands_sdf/5ttg_7kz.sdf
    3501 2020-05-08 17:41 test/pdb_ligands_sdf/4uge_q15.sdf
    5336 2020-05-08 17:41 test/pdb_ligands_sdf/3p50_plc.sdf
    4434 2020-05-08 17:41 test/pdb_ligands_sdf/2hk5_1bm.sdf
    2330 2020-05-08 17:41 test/pdb_ligands_sdf/4k5l_19n.sdf
    2442 2020-05-08 17:41 test/pdb_ligands_sdf/5f2p_5ty.sdf
    2559 2020-05-08 17:41 test/pdb_ligands_sdf/2wcm_b9m.sdf
    1989 2020-05-08 17:41 test/pdb_ligands_sdf/5cjm_4wl.sdf
    2777 2020-05-08 17:41 test/pdb_ligands_sdf/1u3q_272.sdf
    4753 2020-05-08 17:41 test/pdb_ligands_sdf/4lsa_bld.sdf
    1619 2020-05-08 17:41 test/pdb_ligands_sdf/4ytu_ler.sdf
    3964 2020-05-08 17:41 test/pdb_ligands_sdf/2qbr_910.sdf
    1731 2020-05-08 17:41 test/pdb_ligands_sdf/2rkd_3pp.sdf
    3353 2020-05-08 17:41 test/pdb_ligands_sdf/5bv6_35g.sdf
    3273 2020-05-08 17:41 test/pdb_ligands_sdf/4ui8_iy5.sdf
    4285 2020-05-08 17:41 test/pdb_ligands_sdf/3myg_eml.sdf
    1597 2020-05-08 17:41 test/pdb_ligands_sdf/1jqd_hsm.sdf
    1716 2020-05-08 17:41 test/pdb_ligands_sdf/4mre_2c9.sdf
    2434 2020-05-08 17:41 test/pdb_ligands_sdf/4nap_dtr.sdf
    4134 2020-05-08 17:41 test/pdb_ligands_sdf/1fmc_cho.sdf
    3933 2020-05-08 17:41 test/pdb_ligands_sdf/5u8a_82d.sdf
    2999 2020-05-08 17:41 test/pdb_ligands_sdf/2wo8_077.sdf
    3676 2020-05-08 17:41 test/pdb_ligands_sdf/3sr6_mte.sdf
    3389 2020-05-08 17:41 test/pdb_ligands_sdf/2g71_fts.sdf
    4492 2020-05-08 17:41 test/pdb_ligands_sdf/4znh_obc.sdf
    3737 2020-05-08 17:41 test/pdb_ligands_sdf/1v9q_czm.sdf
    4756 2020-05-08 17:41 test/pdb_ligands_sdf/1wop_ffo.sdf
    4072 2020-05-08 17:41 test/pdb_ligands_sdf/2vd4_p21.sdf
    4124 2020-05-08 17:41 test/pdb_ligands_sdf/1m51_tsx.sdf
    6481 2020-05-08 17:41 test/pdb_ligands_sdf/5vce_rit.sdf
    3784 2020-05-08 17:41 test/pdb_ligands_sdf/2bt0_ct5.sdf
    3773 2020-05-08 17:41 test/pdb_ligands_sdf/1zot_ema.sdf
    4124 2020-05-08 17:41 test/pdb_ligands_sdf/3udp_09d.sdf
    3154 2020-05-08 17:41 test/pdb_ligands_sdf/5hjo_xd3.sdf
    3387 2020-05-08 17:41 test/pdb_ligands_sdf/4d4m_bkv.sdf
    1725 2020-05-08 17:41 test/pdb_ligands_sdf/4h85_hri.sdf
    4018 2020-05-08 17:41 test/pdb_ligands_sdf/4xhk_3yr.sdf
    3648 2020-05-08 17:41 test/pdb_ligands_sdf/3cr0_809.sdf
    4322 2020-05-08 17:41 test/pdb_ligands_sdf/4yq2_efy.sdf
    3772 2020-05-08 17:41 test/pdb_ligands_sdf/4r5x_r5x.sdf
    3224 2020-05-08 17:41 test/pdb_ligands_sdf/2g78_rea.sdf
    5177 2020-05-08 17:41 test/pdb_ligands_sdf/3cd5_7hi.sdf
    4392 2020-05-08 17:41 test/pdb_ligands_sdf/3vt3_vdx.sdf
    4846 2020-05-08 17:41 test/pdb_ligands_sdf/5kkt_6u2.sdf
    2994 2020-05-08 17:41 test/pdb_ligands_sdf/2nv7_555.sdf
    2100 2020-05-08 17:41 test/pdb_ligands_sdf/5u60_7vs.sdf
    1246 2020-05-08 17:41 test/pdb_ligands_sdf/3kvi_fah.sdf
    5798 2020-05-08 17:41 test/pdb_ligands_sdf/3l0f_cyc.sdf
    2951 2020-05-08 17:41 test/pdb_ligands_sdf/3v8q_5n5.sdf
    3061 2020-05-08 17:41 test/pdb_ligands_sdf/3ix3_ohn.sdf
    4776 2020-05-08 17:41 test/pdb_ligands_sdf/5nkd_91k.sdf
    6440 2020-05-08 17:41 test/pdb_ligands_sdf/3aga_rcc.sdf
    3555 2020-05-08 17:41 test/pdb_ligands_sdf/2fzk_eoz.sdf
    4799 2020-05-08 17:41 test/pdb_ligands_sdf/4c4g_7ro.sdf
    3327 2020-05-08 17:41 test/pdb_ligands_sdf/1v79_fr7.sdf
    2302 2020-05-08 17:41 test/pdb_ligands_sdf/5ctw_55d.sdf
    4604 2020-05-08 17:41 test/pdb_ligands_sdf/3mw1_mih.sdf
    4070 2020-05-08 17:41 test/pdb_ligands_sdf/3nlt_3xf.sdf
    2197 2020-05-08 17:41 test/pdb_ligands_sdf/1dwx_har.sdf
    1933 2020-05-08 17:41 test/pdb_ligands_sdf/4zaa_4m4.sdf
    3723 2020-05-08 17:41 test/pdb_ligands_sdf/4ynb_4eh.sdf
    3463 2020-05-08 17:41 test/pdb_ligands_sdf/3dyq_pcg.sdf
    3676 2020-05-08 17:41 test/pdb_ligands_sdf/4k5f_q14.sdf
    4576 2020-05-08 17:41 test/pdb_ligands_sdf/1m7q_dqo.sdf
    3553 2020-05-08 17:41 test/pdb_ligands_sdf/2qwi_g20.sdf
    4465 2020-05-08 17:41 test/pdb_ligands_sdf/5j8o_6gz.sdf
    4950 2020-05-08 17:41 test/pdb_ligands_sdf/3bvv_wz3.sdf
    4053 2020-05-08 17:41 test/pdb_ligands_sdf/5d45_57p.sdf
    2729 2020-05-08 17:41 test/pdb_ligands_sdf/1nym_cxb.sdf
    1693 2020-05-08 17:41 test/pdb_ligands_sdf/3kiv_aca.sdf
    1624 2020-05-08 17:41 test/pdb_ligands_sdf/2a31_pg3.sdf
    4058 2020-05-08 17:41 test/pdb_ligands_sdf/1fpu_prc.sdf
    1483 2020-05-08 17:41 test/pdb_ligands_sdf/4qss_mb3.sdf
    3363 2020-05-08 17:41 test/pdb_ligands_sdf/1nup_nmn.sdf
    6200 2020-05-08 17:41 test/pdb_ligands_sdf/5j7f_6gg.sdf
    3791 2020-05-08 17:41 test/pdb_ligands_sdf/4m2x_tmq.sdf
    4362 2020-05-08 17:41 test/pdb_ligands_sdf/5he7_60x.sdf
    2290 2020-05-08 17:41 test/pdb_ligands_sdf/1ami_mic.sdf
    6171 2020-05-08 17:41 test/pdb_ligands_sdf/5d2b_56o.sdf
    3460 2020-05-08 17:41 test/pdb_ligands_sdf/5h8x_5xt.sdf
    2968 2020-05-08 17:41 test/pdb_ligands_sdf/5alm_7gm.sdf
    5682 2020-05-08 17:41 test/pdb_ligands_sdf/1hg4_lpp.sdf
    3776 2020-05-08 17:41 test/pdb_ligands_sdf/3r04_unq.sdf
    2567 2020-05-08 17:41 test/pdb_ligands_sdf/2x68_cte.sdf
    6699 2020-05-08 17:41 test/pdb_ligands_sdf/3lin_e13.sdf
    2173 2020-05-08 17:41 test/pdb_ligands_sdf/1doh_nid.sdf
    3540 2020-05-08 17:41 test/pdb_ligands_sdf/1zgv_501.sdf
    2738 2020-05-08 17:41 test/pdb_ligands_sdf/5u11_7ps.sdf
    3155 2020-05-08 17:41 test/pdb_ligands_sdf/3qjz_qjz.sdf
    3187 2020-05-08 17:41 test/pdb_ligands_sdf/4rsk_u3p.sdf
    6114 2020-05-08 17:41 test/pdb_ligands_sdf/4gtr_7tr.sdf
    3186 2020-05-08 17:41 test/pdb_ligands_sdf/3w7g_w7g.sdf
    3163 2020-05-08 17:41 test/pdb_ligands_sdf/5bzs_4xk.sdf
    3823 2020-05-08 17:41 test/pdb_ligands_sdf/2w5p_cl8.sdf
    2599 2020-05-08 17:41 test/pdb_ligands_sdf/4nwc_2qe.sdf
    4015 2020-05-08 17:41 test/pdb_ligands_sdf/3vev_0h4.sdf
    3988 2020-05-08 17:41 test/pdb_ligands_sdf/4cxx_640.sdf
    5991 2020-05-08 17:41 test/pdb_ligands_sdf/4nfs_naj.sdf
    4059 2020-05-08 17:41 test/pdb_ligands_sdf/5dxu_5h5.sdf
    5920 2020-05-08 17:41 test/pdb_ligands_sdf/2oc2_rx3.sdf
    3644 2020-05-08 17:41 test/pdb_ligands_sdf/4pks_30h.sdf
    2188 2020-05-08 17:41 test/pdb_ligands_sdf/4dx5_c14.sdf
    5065 2020-05-08 17:41 test/pdb_ligands_sdf/4y7g_upg.sdf
    2408 2020-05-08 17:41 test/pdb_ligands_sdf/3k14_535.sdf
    4806 2020-05-08 17:41 test/pdb_ligands_sdf/4foc_0uu.sdf
    3934 2020-05-08 17:41 test/pdb_ligands_sdf/2zt8_drv.sdf
    4919 2020-05-08 17:41 test/pdb_ligands_sdf/6evf_4lu.sdf
    3190 2020-05-08 17:41 test/pdb_ligands_sdf/3h9k_ufp.sdf
    3110 2020-05-08 17:41 test/pdb_ligands_sdf/5bqg_4uj.sdf
    7134 2020-05-08 17:41 test/pdb_ligands_sdf/1fkd_818.sdf
    1820 2020-05-08 17:41 test/pdb_ligands_sdf/3i4y_35c.sdf
    2821 2020-05-08 17:41 test/pdb_ligands_sdf/3oui_42z.sdf
    3024 2020-05-08 17:41 test/pdb_ligands_sdf/1oxl_ida.sdf
    3541 2020-05-08 17:41 test/pdb_ligands_sdf/2vu2_pn5.sdf
    2296 2020-05-08 17:41 test/pdb_ligands_sdf/1q6q_lxp.sdf
    4285 2020-05-08 17:41 test/pdb_ligands_sdf/3zh8_c58.sdf
    3229 2020-05-08 17:41 test/pdb_ligands_sdf/4wkb_tdi.sdf
    2349 2020-05-08 17:41 test/pdb_ligands_sdf/3bi4_298.sdf
    3664 2020-05-08 17:41 test/pdb_ligands_sdf/3qbj_nxz.sdf
    4942 2020-05-08 17:41 test/pdb_ligands_sdf/1iqh_xmf.sdf
    4213 2020-05-08 17:41 test/pdb_ligands_sdf/5iz0_6f1.sdf
    3152 2020-05-08 17:41 test/pdb_ligands_sdf/1tkx_gwb.sdf
    4398 2020-05-08 17:41 test/pdb_ligands_sdf/2zdt_46c.sdf
    3456 2020-05-08 17:41 test/pdb_ligands_sdf/2vbp_vb1.sdf
    3603 2020-05-08 17:41 test/pdb_ligands_sdf/4iw6_1gu.sdf
    4366 2020-05-08 17:41 test/pdb_ligands_sdf/3aur_ca9.sdf
    1837 2020-05-08 17:41 test/pdb_ligands_sdf/3uxl_cfi.sdf
    3274 2020-05-08 17:41 test/pdb_ligands_sdf/3ki2_g9g.sdf
    3724 2020-05-08 17:41 test/pdb_ligands_sdf/3pe2_e1b.sdf
    3938 2020-05-08 17:41 test/pdb_ligands_sdf/5duw_5go.sdf
    1718 2020-05-08 17:41 test/pdb_ligands_sdf/4oek_pea.sdf
    1818 2020-05-08 17:41 test/pdb_ligands_sdf/4b3d_5mi.sdf
    3768 2020-05-08 17:41 test/pdb_ligands_sdf/4pwi_roa.sdf
    1809 2020-05-08 17:41 test/pdb_ligands_sdf/5cq8_ac6.sdf
    2088 2020-05-08 17:41 test/pdb_ligands_sdf/5ai4_4vy.sdf
    2906 2020-05-08 17:41 test/pdb_ligands_sdf/3aez_paz.sdf
    3442 2020-05-08 17:41 test/pdb_ligands_sdf/1l5m_7ra.sdf
    3350 2020-05-08 17:41 test/pdb_ligands_sdf/5niz_8yt.sdf
    4301 2020-05-08 17:41 test/pdb_ligands_sdf/2c92_tp6.sdf
    2356 2020-05-08 17:41 test/pdb_ligands_sdf/4l51_hsx.sdf
    3597 2020-05-08 17:41 test/pdb_ligands_sdf/2wtc_vgm.sdf
    5849 2020-05-08 17:41 test/pdb_ligands_sdf/1gka_axt.sdf
    3340 2020-05-08 17:41 test/pdb_ligands_sdf/4jsf_qj4.sdf
    4949 2020-05-08 17:41 test/pdb_ligands_sdf/1rsd_psb.sdf
    4540 2020-05-08 17:41 test/pdb_ligands_sdf/3q3k_d90.sdf
    3899 2020-05-08 17:41 test/pdb_ligands_sdf/5eai_e6a.sdf
    4055 2020-05-08 17:41 test/pdb_ligands_sdf/3ix8_tx3.sdf
    2590 2020-05-08 17:41 test/pdb_ligands_sdf/3n45_zol.sdf
    2292 2020-05-08 17:41 test/pdb_ligands_sdf/4woh_4np.sdf
    2011 2020-05-08 17:41 test/pdb_ligands_sdf/2pun_sr1.sdf
    3386 2020-05-08 17:41 test/pdb_ligands_sdf/4d4l_bks.sdf
    2213 2020-05-08 17:41 test/pdb_ligands_sdf/1ec8_glr.sdf
    3958 2020-05-08 17:41 test/pdb_ligands_sdf/5jur_6ns.sdf
    2691 2020-05-08 17:41 test/pdb_ligands_sdf/4cxy_dgr.sdf
    3319 2020-05-08 17:41 test/pdb_ligands_sdf/5j1a_6f8.sdf
    3290 2020-05-08 17:41 test/pdb_ligands_sdf/5g1c_9rb.sdf
    3369 2020-05-08 17:41 test/pdb_ligands_sdf/4zof_59l.sdf
    2801 2020-05-08 17:41 test/pdb_ligands_sdf/4gfo_0x2.sdf
    4036 2020-05-08 17:41 test/pdb_ligands_sdf/5w8v_9yp.sdf
    2460 2020-05-08 17:41 test/pdb_ligands_sdf/4cw6_xds.sdf
    2829 2020-05-08 17:41 test/pdb_ligands_sdf/3cj2_sx3.sdf
    2487 2020-05-08 17:41 test/pdb_ligands_sdf/1qvu_prl.sdf
    4120 2020-05-08 17:41 test/pdb_ligands_sdf/2cbo_th2.sdf
    3091 2020-05-08 17:41 test/pdb_ligands_sdf/3ols_est.sdf
    4094 2020-05-08 17:41 test/pdb_ligands_sdf/5t6c_75s.sdf
    4113 2020-05-08 17:41 test/pdb_ligands_sdf/5ewf_ctp.sdf
    4901 2020-05-08 17:41 test/pdb_ligands_sdf/2zla_vdb.sdf
    1971 2020-05-08 17:41 test/pdb_ligands_sdf/4ayu_n8p.sdf
    3525 2020-05-08 17:41 test/pdb_ligands_sdf/3lal_krv.sdf
    4651 2020-05-08 17:41 test/pdb_ligands_sdf/4xt9_43v.sdf
    3769 2020-05-08 17:41 test/pdb_ligands_sdf/5u28_82v.sdf
    4284 2020-05-08 17:41 test/pdb_ligands_sdf/2j34_gs6.sdf
    2467 2020-05-08 17:41 test/pdb_ligands_sdf/1qxy_m2c.sdf
    5001 2020-05-08 17:41 test/pdb_ligands_sdf/5is5_6cy.sdf
    1941 2020-05-08 17:41 test/pdb_ligands_sdf/5x7z_bha.sdf
    2717 2020-05-08 17:41 test/pdb_ligands_sdf/3s4j_unv.sdf
    2661 2020-05-08 17:41 test/pdb_ligands_sdf/4br3_a4v.sdf
    2069 2020-05-08 17:41 test/pdb_ligands_sdf/4nvi_2nw.sdf
    2089 2020-05-08 17:41 test/pdb_ligands_sdf/1i30_826.sdf
    4785 2020-05-08 17:41 test/pdb_ligands_sdf/3vp1_04a.sdf
    6320 2020-05-08 17:41 test/pdb_ligands_sdf/4gh0_eis.sdf
    4005 2020-05-08 17:41 test/pdb_ligands_sdf/3dya_pzl.sdf
    4747 2020-05-08 17:41 test/pdb_ligands_sdf/2yki_yki.sdf
    2152 2020-05-08 17:41 test/pdb_ligands_sdf/4a0h_kap.sdf
    5070 2020-05-08 17:41 test/pdb_ligands_sdf/3nam_otk.sdf
    6075 2020-05-08 17:41 test/pdb_ligands_sdf/4lok_1yd.sdf
    8565 2020-05-08 17:41 test/pdb_ligands_sdf/5dtw_5f9.sdf
    2444 2020-05-08 17:41 test/pdb_ligands_sdf/2uw4_l15.sdf
    5458 2020-05-08 17:41 test/pdb_ligands_sdf/5a0b_jjx.sdf
    1358 2020-05-08 17:41 test/pdb_ligands_sdf/3h3f_oxm.sdf
    4360 2020-05-08 17:41 test/pdb_ligands_sdf/1oir_hdy.sdf
    3830 2020-05-08 17:41 test/pdb_ligands_sdf/5d7c_57w.sdf
    3946 2020-05-08 17:41 test/pdb_ligands_sdf/3tfu_pl8.sdf
    5483 2020-05-08 17:41 test/pdb_ligands_sdf/4kjv_1rk.sdf
    3700 2020-05-08 17:41 test/pdb_ligands_sdf/3zoi_m2w.sdf
    2780 2020-05-08 17:41 test/pdb_ligands_sdf/2csn_cki.sdf
    4418 2020-05-08 17:41 test/pdb_ligands_sdf/5isc_6d0.sdf
    2222 2020-05-08 17:41 test/pdb_ligands_sdf/4y4t_46x.sdf
    3547 2020-05-08 17:41 test/pdb_ligands_sdf/5f20_5u4.sdf
    3501 2020-05-08 17:41 test/pdb_ligands_sdf/4qo7_36v.sdf
    4231 2020-05-08 17:41 test/pdb_ligands_sdf/3rm6_18z.sdf
    4814 2020-05-08 17:41 test/pdb_ligands_sdf/5ap2_pwu.sdf
    4375 2020-05-08 17:41 test/pdb_ligands_sdf/3udq_09e.sdf
    2413 2020-05-08 17:41 test/pdb_ligands_sdf/2cfi_zzz.sdf
    4386 2020-05-08 17:41 test/pdb_ligands_sdf/2cnv_sss.sdf
    4609 2020-05-08 17:41 test/pdb_ligands_sdf/3ffi_3ob.sdf
    4073 2020-05-08 17:41 test/pdb_ligands_sdf/4x1y_loc.sdf
    5402 2020-05-08 17:41 test/pdb_ligands_sdf/5h09_ooo.sdf
    3983 2020-05-08 17:41 test/pdb_ligands_sdf/4u31_mvp.sdf
    2883 2020-05-08 17:41 test/pdb_ligands_sdf/1u19_htg.sdf
    4964 2020-05-08 17:41 test/pdb_ligands_sdf/3gwt_066.sdf
    2042 2020-05-08 17:41 test/pdb_ligands_sdf/2qum_tag.sdf
    3075 2020-05-08 17:41 test/pdb_ligands_sdf/5k0b_6ps.sdf
    3867 2020-05-08 17:41 test/pdb_ligands_sdf/2onc_sy1.sdf
    3707 2020-05-08 17:41 test/pdb_ligands_sdf/2ym5_ym5.sdf
    3915 2020-05-08 17:41 test/pdb_ligands_sdf/5t2b_74o.sdf
    4129 2020-05-08 17:41 test/pdb_ligands_sdf/2gbi_xih.sdf
    4469 2020-05-08 17:41 test/pdb_ligands_sdf/3s4q_nk0.sdf
    3630 2020-05-08 17:41 test/pdb_ligands_sdf/4y63_48o.sdf
    3740 2020-05-08 17:41 test/pdb_ligands_sdf/3g0w_lgb.sdf
    2332 2020-05-08 17:41 test/pdb_ligands_sdf/1bso_brc.sdf
    2947 2020-05-08 17:41 test/pdb_ligands_sdf/2a5c_8da.sdf
    3787 2020-05-08 17:41 test/pdb_ligands_sdf/5wo4_b7v.sdf
    5937 2020-05-08 17:41 test/pdb_ligands_sdf/3c72_cx1.sdf
    4667 2020-05-08 17:41 test/pdb_ligands_sdf/2chm_3p4.sdf
    2537 2020-05-08 17:41 test/pdb_ligands_sdf/5aia_kwb.sdf
    2060 2020-05-08 17:41 test/pdb_ligands_sdf/3urk_0cg.sdf
    4424 2020-05-08 17:41 test/pdb_ligands_sdf/4ky4_04j.sdf
    3577 2020-05-08 17:41 test/pdb_ligands_sdf/2yg2_s1p.sdf
    3769 2020-05-08 17:41 test/pdb_ligands_sdf/2hai_pfi.sdf
    3248 2020-05-08 17:41 test/pdb_ligands_sdf/3acj_kss.sdf
    6288 2020-05-08 17:41 test/pdb_ligands_sdf/5l30_70a.sdf
    3181 2020-05-08 17:41 test/pdb_ligands_sdf/1me7_rvp.sdf
    3645 2020-05-08 17:41 test/pdb_ligands_sdf/5lle_v51.sdf
    2926 2020-05-08 17:41 test/pdb_ligands_sdf/3qfv_nm7.sdf
    2687 2020-05-08 17:41 test/pdb_ligands_sdf/5a7q_kch.sdf
    1939 2020-05-08 17:41 test/pdb_ligands_sdf/1yhy_p22.sdf
    3555 2020-05-08 17:41 test/pdb_ligands_sdf/5svf_70p.sdf
    4211 2020-05-08 17:41 test/pdb_ligands_sdf/3ppk_fni.sdf
    4555 2020-05-08 17:41 test/pdb_ligands_sdf/5wry_4yr.sdf
    3355 2020-05-08 17:41 test/pdb_ligands_sdf/3ccn_lkg.sdf
    3990 2020-05-08 17:41 test/pdb_ligands_sdf/4mlp_2cx.sdf
    5773 2020-05-08 17:41 test/pdb_ligands_sdf/5vds_9bj.sdf
    2068 2020-05-08 17:41 test/pdb_ligands_sdf/5dbi_xog.sdf
    2305 2020-05-08 17:41 test/pdb_ligands_sdf/1uwt_gtl.sdf
    2815 2020-05-08 17:41 test/pdb_ligands_sdf/1wvj_ibc.sdf
    4056 2020-05-08 17:41 test/pdb_ligands_sdf/4ytf_4hz.sdf
    3577 2020-05-08 17:41 test/pdb_ligands_sdf/3qi3_pdb.sdf
    1925 2020-05-08 17:41 test/pdb_ligands_sdf/5noy_93k.sdf
    2469 2020-05-08 17:41 test/pdb_ligands_sdf/4y5e_47t.sdf
    4015 2020-05-08 17:41 test/pdb_ligands_sdf/4qwd_3tt.sdf
    4002 2020-05-08 17:41 test/pdb_ligands_sdf/4q0a_4oa.sdf
    2468 2020-05-08 17:41 test/pdb_ligands_sdf/1o4f_790.sdf
    4465 2020-05-08 17:41 test/pdb_ligands_sdf/4nka_2k7.sdf
    5389 2020-05-08 17:41 test/pdb_ligands_sdf/2hb3_grl.sdf
    3147 2020-05-08 17:41 test/pdb_ligands_sdf/3bhm_ab3.sdf
    7854 2020-05-08 17:41 test/pdb_ligands_sdf/4cp3_rbt.sdf
    3820 2020-05-08 17:41 test/pdb_ligands_sdf/4cbt_9f4.sdf
    3734 2020-05-08 17:41 test/pdb_ligands_sdf/5mxx_w4a.sdf
    4604 2020-05-08 17:41 test/pdb_ligands_sdf/1od7_suw.sdf
    4965 2020-05-08 17:41 test/pdb_ligands_sdf/4a5y_g7x.sdf
    2884 2020-05-08 17:41 test/pdb_ligands_sdf/3svh_krg.sdf
    3842 2020-05-08 17:41 test/pdb_ligands_sdf/4wke_3pu.sdf
    3858 2020-05-08 17:41 test/pdb_ligands_sdf/1lr8_ihs.sdf
    3898 2020-05-08 17:41 test/pdb_ligands_sdf/4n8r_k08.sdf
    3364 2020-05-08 17:41 test/pdb_ligands_sdf/2g6p_hm2.sdf
    2046 2020-05-08 17:41 test/pdb_ligands_sdf/4nhk_pd2.sdf
    7319 2020-05-08 17:41 test/pdb_ligands_sdf/3e7b_e7b.sdf
    2468 2020-05-08 17:41 test/pdb_ligands_sdf/5ii1_6bl.sdf
    3439 2020-05-08 17:41 test/pdb_ligands_sdf/1z8n_1iq.sdf
    4587 2020-05-08 17:41 test/pdb_ligands_sdf/4zyu_3ya.sdf
    2979 2020-05-08 17:41 test/pdb_ligands_sdf/2ada_hpr.sdf
    5087 2020-05-08 17:41 test/pdb_ligands_sdf/4ge9_0l0.sdf
    3401 2020-05-08 17:41 test/pdb_ligands_sdf/3t1d_td1.sdf
    4070 2020-05-08 17:41 test/pdb_ligands_sdf/2bve_ph5.sdf
    4359 2020-05-08 17:41 test/pdb_ligands_sdf/4ixu_38i.sdf
    2648 2020-05-08 17:41 test/pdb_ligands_sdf/4ypw_4fd.sdf
    4480 2020-05-08 17:41 test/pdb_ligands_sdf/4q1d_2y1.sdf
    2977 2020-05-08 17:41 test/pdb_ligands_sdf/4ith_rcm.sdf
    4092 2020-05-08 17:41 test/pdb_ligands_sdf/2zk6_c08.sdf
    4381 2020-05-08 17:41 test/pdb_ligands_sdf/5h8e_5y3.sdf
    4015 2020-05-08 17:41 test/pdb_ligands_sdf/4a7c_e46.sdf
    3962 2020-05-08 17:41 test/pdb_ligands_sdf/1xuc_pb3.sdf
    3029 2020-05-08 17:41 test/pdb_ligands_sdf/3euf_bau.sdf
    3072 2020-05-08 17:41 test/pdb_ligands_sdf/2a5b_8hg.sdf
    6016 2020-05-08 17:41 test/pdb_ligands_sdf/3hxb_bd5.sdf
    4404 2020-05-08 17:41 test/pdb_ligands_sdf/3q7j_fbo.sdf
    3687 2020-05-08 17:41 test/pdb_ligands_sdf/3srv_s19.sdf
    3479 2020-05-08 17:41 test/pdb_ligands_sdf/3cav_ci2.sdf
    2146 2020-05-08 17:41 test/pdb_ligands_sdf/3o15_ifp.sdf
    8260 2020-05-08 17:41 test/pdb_ligands_sdf/3zt6_acx.sdf
    4551 2020-05-08 17:41 test/pdb_ligands_sdf/4fhh_0u3.sdf
    1999 2020-05-08 17:41 test/pdb_ligands_sdf/5cah_4za.sdf
    3655 2020-05-08 17:41 test/pdb_ligands_sdf/4i9d_l4d.sdf
    4975 2020-05-08 17:41 test/pdb_ligands_sdf/1iqi_xmg.sdf
    4519 2020-05-08 17:41 test/pdb_ligands_sdf/3qd3_3q5.sdf
    2674 2020-05-08 17:41 test/pdb_ligands_sdf/3nty_5p3.sdf
    2331 2020-05-08 17:41 test/pdb_ligands_sdf/1yki_nfz.sdf
    3333 2020-05-08 17:41 test/pdb_ligands_sdf/4ugn_h49.sdf
    3966 2020-05-08 17:41 test/pdb_ligands_sdf/2f98_ngv.sdf
    3195 2020-05-08 17:41 test/pdb_ligands_sdf/5vkr_apr.sdf
    3080 2020-05-08 17:41 test/pdb_ligands_sdf/1oum_tal.sdf
    3289 2020-05-08 17:41 test/pdb_ligands_sdf/4ugh_4v4.sdf
    2559 2020-05-08 17:41 test/pdb_ligands_sdf/2uy5_h35.sdf
    3781 2020-05-08 17:41 test/pdb_ligands_sdf/3wk3_o7e.sdf
    1723 2020-05-08 17:41 test/pdb_ligands_sdf/4n1q_wm2.sdf
    1821 2020-05-08 17:41 test/pdb_ligands_sdf/5csv_gab.sdf
    2064 2020-05-08 17:41 test/pdb_ligands_sdf/1v1a_kdg.sdf
    3858 2020-05-08 17:41 test/pdb_ligands_sdf/5hz8_65z.sdf
    4527 2020-05-08 17:41 test/pdb_ligands_sdf/4oth_drn.sdf
    3219 2020-05-08 17:41 test/pdb_ligands_sdf/2ony_tmj.sdf
    4608 2020-05-08 17:41 test/pdb_ligands_sdf/2ez8_tdl.sdf
    3167 2020-05-08 17:41 test/pdb_ligands_sdf/6aom_p33.sdf
    4611 2020-05-08 17:41 test/pdb_ligands_sdf/4ixc_1jd.sdf
    4895 2020-05-08 17:41 test/pdb_ligands_sdf/4rn6_15u.sdf
    3896 2020-05-08 17:41 test/pdb_ligands_sdf/4bci_t3e.sdf
    3644 2020-05-08 17:41 test/pdb_ligands_sdf/5knt_6wb.sdf
    3251 2020-05-08 17:41 test/pdb_ligands_sdf/3bla_dd3.sdf
    4940 2020-05-08 17:41 test/pdb_ligands_sdf/5vcz_xzn.sdf
    2484 2020-05-08 17:41 test/pdb_ligands_sdf/5l96_6rz.sdf
    2161 2020-05-08 17:41 test/pdb_ligands_sdf/5mzj_tep.sdf
    4055 2020-05-08 17:41 test/pdb_ligands_sdf/1pwl_bfi.sdf
    3561 2020-05-08 17:41 test/pdb_ligands_sdf/3fwa_ren.sdf
    4206 2020-05-08 17:41 test/pdb_ligands_sdf/2p8s_417.sdf
    3431 2020-05-08 17:41 test/pdb_ligands_sdf/3lj2_iza.sdf
    2645 2020-05-08 17:41 test/pdb_ligands_sdf/4kq2_1s3.sdf
    3674 2020-05-08 17:41 test/pdb_ligands_sdf/3fgo_cza.sdf
    6499 2020-05-08 17:41 test/pdb_ligands_sdf/5ntk_99n.sdf
    3925 2020-05-08 17:41 test/pdb_ligands_sdf/5kmn_6uk.sdf
    3888 2020-05-08 17:41 test/pdb_ligands_sdf/4gee_0wt.sdf
    4228 2020-05-08 17:41 test/pdb_ligands_sdf/5on1_9yk.sdf
    4104 2020-05-08 17:41 test/pdb_ligands_sdf/5dyt_5hb.sdf
    3299 2020-05-08 17:41 test/pdb_ligands_sdf/4ugi_sko.sdf
    3993 2020-05-08 17:41 test/pdb_ligands_sdf/5a86_d7e.sdf
    4526 2020-05-08 17:41 test/pdb_ligands_sdf/4i1c_1be.sdf
    2852 2020-05-08 17:41 test/pdb_ligands_sdf/1c88_ota.sdf
    2544 2020-05-08 17:41 test/pdb_ligands_sdf/4gny_sds.sdf
    3705 2020-05-08 17:41 test/pdb_ligands_sdf/4rzg_zhn.sdf
    3244 2020-05-08 17:41 test/pdb_ligands_sdf/4xh6_hul.sdf
    4123 2020-05-08 17:41 test/pdb_ligands_sdf/3fvp_ub2.sdf
    2688 2020-05-08 17:41 test/pdb_ligands_sdf/3omo_wv7.sdf
    3861 2020-05-08 17:41 test/pdb_ligands_sdf/2aaq_aup.sdf
    4205 2020-05-08 17:41 test/pdb_ligands_sdf/1g5s_i17.sdf
    3472 2020-05-08 17:41 test/pdb_ligands_sdf/3w9b_pe8.sdf
    4485 2020-05-08 17:41 test/pdb_ligands_sdf/5kpq_6x2.sdf
    4234 2020-05-08 17:41 test/pdb_ligands_sdf/4cf9_5ey.sdf
    2207 2020-05-08 17:41 test/pdb_ligands_sdf/1nis_ntc.sdf
    4681 2020-05-08 17:41 test/pdb_ligands_sdf/5fdo_5x2.sdf
    3130 2020-05-08 17:41 test/pdb_ligands_sdf/1pk9_2fa.sdf
    2911 2020-05-08 17:41 test/pdb_ligands_sdf/2f94_bfq.sdf
    2267 2020-05-08 17:41 test/pdb_ligands_sdf/3ccb_b2y.sdf
    3997 2020-05-08 17:41 test/pdb_ligands_sdf/3eb1_lzq.sdf
    1958 2020-05-08 17:41 test/pdb_ligands_sdf/5fe2_5wv.sdf
    1441 2020-05-08 17:41 test/pdb_ligands_sdf/2r0y_aly.sdf
    3406 2020-05-08 17:41 test/pdb_ligands_sdf/3w3l_rx8.sdf
    3625 2020-05-08 17:41 test/pdb_ligands_sdf/4m3q_24k.sdf
    4373 2020-05-08 17:41 test/pdb_ligands_sdf/3ska_053.sdf
    3605 2020-05-08 17:41 test/pdb_ligands_sdf/2vzq_unf.sdf
    4347 2020-05-08 17:41 test/pdb_ligands_sdf/3h6k_33t.sdf
    3009 2020-05-08 17:41 test/pdb_ligands_sdf/5dk4_5bx.sdf
    4274 2020-05-08 17:41 test/pdb_ligands_sdf/2e98_b29.sdf
    4018 2020-05-08 17:41 test/pdb_ligands_sdf/5ikw_6bu.sdf
    4291 2020-05-08 17:41 test/pdb_ligands_sdf/4zbf_4m7.sdf
    2703 2020-05-08 17:41 test/pdb_ligands_sdf/2f6w_un3.sdf
    4313 2020-05-08 17:41 test/pdb_ligands_sdf/3ow3_smy.sdf
    2145 2020-05-08 17:41 test/pdb_ligands_sdf/5e9x_5la.sdf
    4802 2020-05-08 17:41 test/pdb_ligands_sdf/2j2i_ly4.sdf
    4550 2020-05-08 17:41 test/pdb_ligands_sdf/3eq8_x98.sdf
    6242 2020-05-08 17:41 test/pdb_ligands_sdf/4wmr_865.sdf
    4152 2020-05-08 17:41 test/pdb_ligands_sdf/3qa2_xna.sdf
    7003 2020-05-08 17:41 test/pdb_ligands_sdf/2get_cok.sdf
    1968 2020-05-08 17:41 test/pdb_ligands_sdf/2fxl_2al.sdf
    3832 2020-05-08 17:41 test/pdb_ligands_sdf/5fhm_5xp.sdf
    4256 2020-05-08 17:41 test/pdb_ligands_sdf/2aio_mx1.sdf
    2084 2020-05-08 17:41 test/pdb_ligands_sdf/5ngr_8wt.sdf
    5105 2020-05-08 17:41 test/pdb_ligands_sdf/3p6n_dso.sdf
    2812 2020-05-08 17:41 test/pdb_ligands_sdf/3pmu_f7l.sdf
    4537 2020-05-08 17:41 test/pdb_ligands_sdf/2bvx_5cb.sdf
    3450 2020-05-08 17:41 test/pdb_ligands_sdf/2ivs_ack.sdf
    3302 2020-05-08 17:41 test/pdb_ligands_sdf/3wv3_wll.sdf
    7450 2020-05-08 17:41 test/pdb_ligands_sdf/4i2i_ap5.sdf
    4471 2020-05-08 17:41 test/pdb_ligands_sdf/5ghq_6u4.sdf
    2288 2020-05-08 17:41 test/pdb_ligands_sdf/1ive_st3.sdf
    4238 2020-05-08 17:41 test/pdb_ligands_sdf/3fzk_3bk.sdf
    7004 2020-05-08 17:41 test/pdb_ligands_sdf/2p59_gg4.sdf
    4187 2020-05-08 17:41 test/pdb_ligands_sdf/4s0t_40u.sdf
    3374 2020-05-08 17:41 test/pdb_ligands_sdf/3hac_361.sdf
    4300 2020-05-08 17:41 test/pdb_ligands_sdf/2yir_yir.sdf
    3939 2020-05-08 17:41 test/pdb_ligands_sdf/1i7g_az2.sdf
    5803 2020-05-08 17:41 test/pdb_ligands_sdf/4cqe_cqe.sdf
    2984 2020-05-08 17:41 test/pdb_ligands_sdf/2rhr_emo.sdf
    3893 2020-05-08 17:41 test/pdb_ligands_sdf/5xkm_87r.sdf
    2408 2020-05-08 17:41 test/pdb_ligands_sdf/3dne_ll1.sdf
    6673 2020-05-08 17:41 test/pdb_ligands_sdf/5naj_8se.sdf
    5412 2020-05-08 17:41 test/pdb_ligands_sdf/4djq_m86.sdf
    4585 2020-05-08 17:41 test/pdb_ligands_sdf/1yp9_uiz.sdf
    2352 2020-05-08 17:41 test/pdb_ligands_sdf/5mge_7mx.sdf
    4384 2020-05-08 17:41 test/pdb_ligands_sdf/3a0i_aji.sdf
    2696 2020-05-08 17:41 test/pdb_ligands_sdf/4f1l_0ry.sdf
    2803 2020-05-08 17:41 test/pdb_ligands_sdf/2c97_jcl.sdf
    2275 2020-05-08 17:41 test/pdb_ligands_sdf/3kef_dma.sdf
    2344 2020-05-08 17:41 test/pdb_ligands_sdf/5uq0_wp1.sdf
    4396 2020-05-08 17:41 test/pdb_ligands_sdf/5val_92d.sdf
    4541 2020-05-08 17:41 test/pdb_ligands_sdf/5hvs_65v.sdf
    1923 2020-05-08 17:41 test/pdb_ligands_sdf/2a85_hoc.sdf
    3797 2020-05-08 17:41 test/pdb_ligands_sdf/5ek9_5p4.sdf
    2811 2020-05-08 17:41 test/pdb_ligands_sdf/3omq_w23.sdf
    3413 2020-05-08 17:41 test/pdb_ligands_sdf/5ht4_65j.sdf
    4629 2020-05-08 17:41 test/pdb_ligands_sdf/4g1n_nzt.sdf
    3995 2020-05-08 17:41 test/pdb_ligands_sdf/1n4p_grg.sdf
    4612 2020-05-08 17:41 test/pdb_ligands_sdf/2iw6_qq2.sdf
    3851 2020-05-08 17:41 test/pdb_ligands_sdf/3g0c_ruf.sdf
    4371 2020-05-08 17:41 test/pdb_ligands_sdf/1r6g_442.sdf
    1695 2020-05-08 17:41 test/pdb_ligands_sdf/1xlm_xyl.sdf
    4938 2020-05-08 17:41 test/pdb_ligands_sdf/5q1h_9np.sdf
    2187 2020-05-08 17:41 test/pdb_ligands_sdf/4e5f_0n7.sdf
    2460 2020-05-08 17:41 test/pdb_ligands_sdf/4njg_hhs.sdf
    4559 2020-05-08 17:41 test/pdb_ligands_sdf/1jbw_tmf.sdf
    2305 2020-05-08 17:41 test/pdb_ligands_sdf/5bx0_4w5.sdf
    1953 2020-05-08 17:41 test/pdb_ligands_sdf/5h4i_7hq.sdf
    4032 2020-05-08 17:41 test/pdb_ligands_sdf/4fsq_hk3.sdf
    4894 2020-05-08 17:41 test/pdb_ligands_sdf/4zts_4rk.sdf
    4486 2020-05-08 17:41 test/pdb_ligands_sdf/4uix_tvu.sdf
    4662 2020-05-08 17:41 test/pdb_ligands_sdf/5lrl_73s.sdf
    2848 2020-05-08 17:41 test/pdb_ligands_sdf/4e9u_rwy.sdf
    4448 2020-05-08 17:41 test/pdb_ligands_sdf/3ik9_bob.sdf
    4088 2020-05-08 17:41 test/pdb_ligands_sdf/3f0q_52v.sdf
    4467 2020-05-08 17:41 test/pdb_ligands_sdf/1iql_xmj.sdf
    6730 2020-05-08 17:41 test/pdb_ligands_sdf/5qc6_bcj.sdf
    3914 2020-05-08 17:41 test/pdb_ligands_sdf/4jh0_1md.sdf
    3153 2020-05-08 17:41 test/pdb_ligands_sdf/5fh8_5xk.sdf
    4454 2020-05-08 17:41 test/pdb_ligands_sdf/4fps_0ux.sdf
    6195 2020-05-08 17:41 test/pdb_ligands_sdf/4f6w_0ss.sdf
    2799 2020-05-08 17:41 test/pdb_ligands_sdf/5mrm_q9t.sdf
    2542 2020-05-08 17:41 test/pdb_ligands_sdf/1zh0_nal.sdf
    4519 2020-05-08 17:41 test/pdb_ligands_sdf/5uwn_8o7.sdf
    4924 2020-05-08 17:41 test/pdb_ligands_sdf/5vcy_db8.sdf
    3125 2020-05-08 17:41 test/pdb_ligands_sdf/3ddg_gb7.sdf
    4020 2020-05-08 17:41 test/pdb_ligands_sdf/1gj9_134.sdf
    3527 2020-05-08 17:41 test/pdb_ligands_sdf/1qju_w01.sdf
    3393 2020-05-08 17:41 test/pdb_ligands_sdf/3sp3_suc.sdf
    7256 2020-05-08 17:41 test/pdb_ligands_sdf/5lzi_7bq.sdf
    4725 2020-05-08 17:41 test/pdb_ligands_sdf/5y2t_8lx.sdf
    3628 2020-05-08 17:41 test/pdb_ligands_sdf/4b2h_c3f.sdf
    3471 2020-05-08 17:41 test/pdb_ligands_sdf/4bo1_nkh.sdf
    2844 2020-05-08 17:41 test/pdb_ligands_sdf/1c81_fdq.sdf
    1561 2020-05-08 17:41 test/pdb_ligands_sdf/1o6f_sin.sdf
    3476 2020-05-08 17:41 test/pdb_ligands_sdf/4u58_3c6.sdf
    5768 2020-05-08 17:41 test/pdb_ligands_sdf/5hti_66l.sdf
    2811 2020-05-08 17:41 test/pdb_ligands_sdf/5kdq_koh.sdf
    3864 2020-05-08 17:41 test/pdb_ligands_sdf/3e01_pz2.sdf
    3630 2020-05-08 17:41 test/pdb_ligands_sdf/2abi_1ca.sdf
    3929 2020-05-08 17:41 test/pdb_ligands_sdf/4gsu_dwz.sdf
    1819 2020-05-08 17:41 test/pdb_ligands_sdf/3bi5_dia.sdf
    3489 2020-05-08 17:41 test/pdb_ligands_sdf/3iw7_ipk.sdf
    2843 2020-05-08 17:41 test/pdb_ligands_sdf/3pfp_035.sdf
    3125 2020-05-08 17:41 test/pdb_ligands_sdf/3hig_brn.sdf
    3372 2020-05-08 17:41 test/pdb_ligands_sdf/4ze3_tpf.sdf
    2607 2020-05-08 17:41 test/pdb_ligands_sdf/5u0y_7pj.sdf
    2451 2020-05-08 17:41 test/pdb_ligands_sdf/5x69_7zc.sdf
    4394 2020-05-08 17:41 test/pdb_ligands_sdf/3gi2_ghw.sdf
    1012 2020-05-08 17:41 test/pdb_ligands_sdf/2z9l_daz.sdf
    3759 2020-05-08 17:41 test/pdb_ligands_sdf/1tka_n3t.sdf
    2424 2020-05-08 17:41 test/pdb_ligands_sdf/4ph9_ibp.sdf
    3541 2020-05-08 17:41 test/pdb_ligands_sdf/6bp0_e1d.sdf
    2090 2020-05-08 17:41 test/pdb_ligands_sdf/3my6_my6.sdf
    4838 2020-05-08 17:41 test/pdb_ligands_sdf/5g2n_6e2.sdf
    4010 2020-05-08 17:41 test/pdb_ligands_sdf/5iin_dup.sdf
    5010 2020-05-08 17:41 test/pdb_ligands_sdf/4cer_vl4.sdf
    4267 2020-05-08 17:41 test/pdb_ligands_sdf/2bq7_iid.sdf
    3274 2020-05-08 17:41 test/pdb_ligands_sdf/4nc5_fsi.sdf
    3620 2020-05-08 17:41 test/pdb_ligands_sdf/3dp3_4bb.sdf
    2187 2020-05-08 17:41 test/pdb_ligands_sdf/3hfz_mty.sdf
    3455 2020-05-08 17:41 test/pdb_ligands_sdf/1y0x_t44.sdf
    5184 2020-05-08 17:41 test/pdb_ligands_sdf/4na8_1t6.sdf
    2609 2020-05-08 17:41 test/pdb_ligands_sdf/5o4f_8ve.sdf
    2652 2020-05-08 17:41 test/pdb_ligands_sdf/2no7_ldc.sdf
    3394 2020-05-08 17:41 test/pdb_ligands_sdf/4y83_49b.sdf
    3400 2020-05-08 17:41 test/pdb_ligands_sdf/5f94_3uo.sdf
    3306 2020-05-08 17:41 test/pdb_ligands_sdf/1nmz_nym.sdf
    3844 2020-05-08 17:41 test/pdb_ligands_sdf/4xvd_wdv.sdf
    3356 2020-05-08 17:41 test/pdb_ligands_sdf/1i9o_ioc.sdf
    3417 2020-05-08 17:41 test/pdb_ligands_sdf/1uob_pnn.sdf
    1859 2020-05-08 17:41 test/pdb_ligands_sdf/5b8d_6t4.sdf
    3194 2020-05-08 17:41 test/pdb_ligands_sdf/5v0v_8qp.sdf
    2351 2020-05-08 17:41 test/pdb_ligands_sdf/5f3d_5uk.sdf
    2322 2020-05-08 17:41 test/pdb_ligands_sdf/1qll_tda.sdf
    6335 2020-05-08 17:41 test/pdb_ligands_sdf/4jyw_t57.sdf
    6181 2020-05-08 17:41 test/pdb_ligands_sdf/4f2a_2ob.sdf
    5901 2020-05-08 17:41 test/pdb_ligands_sdf/2rfn_am7.sdf
    4506 2020-05-08 17:41 test/pdb_ligands_sdf/4lts_lts.sdf
    3084 2020-05-08 17:41 test/pdb_ligands_sdf/4dsc_a8s.sdf
    5773 2020-05-08 17:41 test/pdb_ligands_sdf/5gwi_n2r.sdf
    3589 2020-05-08 17:41 test/pdb_ligands_sdf/4iui_1gq.sdf
    3946 2020-05-08 17:41 test/pdb_ligands_sdf/2ypu_i41.sdf
    2947 2020-05-08 17:41 test/pdb_ligands_sdf/1ndw_fr2.sdf
    4621 2020-05-08 17:41 test/pdb_ligands_sdf/5uex_89d.sdf
    2795 2020-05-08 17:41 test/pdb_ligands_sdf/2g1a_5hg.sdf
    2887 2020-05-08 17:41 test/pdb_ligands_sdf/4b80_a36.sdf
    2561 2020-05-08 17:41 test/pdb_ligands_sdf/1zd3_nc4.sdf
    3634 2020-05-08 17:41 test/pdb_ligands_sdf/3uhm_rfn.sdf
    3853 2020-05-08 17:41 test/pdb_ligands_sdf/4c7k_dzl.sdf
    3293 2020-05-08 17:41 test/pdb_ligands_sdf/1hge_mna.sdf
    1928 2020-05-08 17:41 test/pdb_ligands_sdf/5pah_ldp.sdf
    3507 2020-05-08 17:41 test/pdb_ligands_sdf/3ch6_311.sdf
    4682 2020-05-08 17:41 test/pdb_ligands_sdf/3vt8_yi3.sdf
    2902 2020-05-08 17:41 test/pdb_ligands_sdf/3tl1_jro.sdf
    4176 2020-05-08 17:41 test/pdb_ligands_sdf/1kz8_pfe.sdf
    5490 2020-05-08 17:41 test/pdb_ligands_sdf/4x5y_3xw.sdf
    5572 2020-05-08 17:41 test/pdb_ligands_sdf/2wxj_rw3.sdf
    3616 2020-05-08 17:41 test/pdb_ligands_sdf/3uon_qnb.sdf
    4618 2020-05-08 17:41 test/pdb_ligands_sdf/1ta6_177.sdf
    4747 2020-05-08 17:41 test/pdb_ligands_sdf/5u45_7sy.sdf
    3610 2020-05-08 17:41 test/pdb_ligands_sdf/4zw5_4sa.sdf
    2447 2020-05-08 17:41 test/pdb_ligands_sdf/3n1v_3n1.sdf
    1719 2020-05-08 17:41 test/pdb_ligands_sdf/3eeo_pdi.sdf
    5159 2020-05-08 17:41 test/pdb_ligands_sdf/3wvc_zgp.sdf
    3916 2020-05-08 17:41 test/pdb_ligands_sdf/3u2k_087.sdf
    2309 2020-05-08 17:41 test/pdb_ligands_sdf/1t4p_2bh.sdf
    2700 2020-05-08 17:41 test/pdb_ligands_sdf/5ipz_6cc.sdf
    2896 2020-05-08 17:41 test/pdb_ligands_sdf/2gg2_u12.sdf
    4440 2020-05-08 17:41 test/pdb_ligands_sdf/5p9e_77s.sdf
    3800 2020-05-08 17:41 test/pdb_ligands_sdf/3wg8_6as.sdf
    2723 2020-05-08 17:41 test/pdb_ligands_sdf/1a7a_adc.sdf
    4038 2020-05-08 17:41 test/pdb_ligands_sdf/4ugw_hw1.sdf
    3470 2020-05-08 17:41 test/pdb_ligands_sdf/4efe_0ov.sdf
    4206 2020-05-08 17:41 test/pdb_ligands_sdf/4uxl_5p8.sdf
    2432 2020-05-08 17:41 test/pdb_ligands_sdf/5uet_87v.sdf
    2356 2020-05-08 17:41 test/pdb_ligands_sdf/5mpz_4i8.sdf
    4323 2020-05-08 17:41 test/pdb_ligands_sdf/2o4j_vd4.sdf
    5733 2020-05-08 17:41 test/pdb_ligands_sdf/1he3_mbv.sdf
    3796 2020-05-08 17:41 test/pdb_ligands_sdf/4gfg_0xf.sdf
    6689 2020-05-08 17:41 test/pdb_ligands_sdf/4my6_3vh.sdf
    4178 2020-05-08 17:41 test/pdb_ligands_sdf/4ncg_2kw.sdf
    4340 2020-05-08 17:41 test/pdb_ligands_sdf/5mex_pap.sdf
    2698 2020-05-08 17:41 test/pdb_ligands_sdf/5dq2_5ho.sdf
    2104 2020-05-08 17:41 test/pdb_ligands_sdf/3d1v_d1v.sdf
    4026 2020-05-08 17:41 test/pdb_ligands_sdf/4x3t_45e.sdf
    2213 2020-05-08 17:41 test/pdb_ligands_sdf/5c9w_4z3.sdf
    2529 2020-05-08 17:41 test/pdb_ligands_sdf/3u9c_04g.sdf
    4665 2020-05-08 17:41 test/pdb_ligands_sdf/1dkf_bms.sdf
    3632 2020-05-08 17:41 test/pdb_ligands_sdf/4d32_7f5.sdf
    4386 2020-05-08 17:41 test/pdb_ligands_sdf/4bcq_tjf.sdf
    3747 2020-05-08 17:41 test/pdb_ligands_sdf/5j5t_6g2.sdf
    2233 2020-05-08 17:41 test/pdb_ligands_sdf/1zwh_rde.sdf
    2188 2020-05-08 17:41 test/pdb_ligands_sdf/4nvl_2nz.sdf
    2776 2020-05-08 17:41 test/pdb_ligands_sdf/4hd8_pit.sdf
    4034 2020-05-08 17:41 test/pdb_ligands_sdf/4ctv_7s7.sdf
    2539 2020-05-08 17:41 test/pdb_ligands_sdf/1ldo_snr.sdf
    1486 2020-05-08 17:41 test/pdb_ligands_sdf/4rcv_de2.sdf
    4487 2020-05-08 17:41 test/pdb_ligands_sdf/5g4s_8vi.sdf
    4146 2020-05-08 17:41 test/pdb_ligands_sdf/1r3j_dga.sdf
    3622 2020-05-08 17:41 test/pdb_ligands_sdf/5unw_8f7.sdf
    4224 2020-05-08 17:41 test/pdb_ligands_sdf/2w05_frt.sdf
    2344 2020-05-08 17:41 test/pdb_ligands_sdf/4qp7_363.sdf
    2280 2020-05-08 17:41 test/pdb_ligands_sdf/4fgc_pq0.sdf
    3499 2020-05-08 17:41 test/pdb_ligands_sdf/1qy8_rdi.sdf
    2807 2020-05-08 17:41 test/pdb_ligands_sdf/2pe0_39z.sdf
    3567 2020-05-08 17:41 test/pdb_ligands_sdf/2vau_v20.sdf
    2073 2020-05-08 17:41 test/pdb_ligands_sdf/3aua_f98.sdf
    2039 2020-05-08 17:41 test/pdb_ligands_sdf/4y37_45j.sdf
    4357 2020-05-08 17:41 test/pdb_ligands_sdf/3i5z_z48.sdf
    2950 2020-05-08 17:41 test/pdb_ligands_sdf/5bzj_4wn.sdf
    3915 2020-05-08 17:41 test/pdb_ligands_sdf/5uvs_8o1.sdf
    2760 2020-05-08 17:41 test/pdb_ligands_sdf/5axd_rbv.sdf
    5142 2020-05-08 17:41 test/pdb_ligands_sdf/3kxz_925.sdf
    4683 2020-05-08 17:41 test/pdb_ligands_sdf/4rwk_66t.sdf
    5545 2020-05-08 17:41 test/pdb_ligands_sdf/5e7v_m7e.sdf
    1830 2020-05-08 17:41 test/pdb_ligands_sdf/4afz_tar.sdf
    4583 2020-05-08 17:41 test/pdb_ligands_sdf/3btj_deq.sdf
    3720 2020-05-08 17:41 test/pdb_ligands_sdf/4ytc_4hw.sdf
    4031 2020-05-08 17:41 test/pdb_ligands_sdf/5ovx_ay5.sdf
    5749 2020-05-08 17:41 test/pdb_ligands_sdf/5cop_53f.sdf
    3368 2020-05-08 17:41 test/pdb_ligands_sdf/4f7j_0su.sdf
    4196 2020-05-08 17:41 test/pdb_ligands_sdf/3kyt_hc2.sdf
    3708 2020-05-08 17:41 test/pdb_ligands_sdf/1hb2_scv.sdf
    4788 2020-05-08 17:41 test/pdb_ligands_sdf/5k9d_ce9.sdf
    4636 2020-05-08 17:41 test/pdb_ligands_sdf/2w17_i19.sdf
    6947 2020-05-08 17:41 test/pdb_ligands_sdf/4j7n_gtg.sdf
    6043 2020-05-08 17:41 test/pdb_ligands_sdf/1mbb_eeb.sdf
    5214 2020-05-08 17:41 test/pdb_ligands_sdf/4kqq_vpp.sdf
    3330 2020-05-08 17:41 test/pdb_ligands_sdf/4qhc_33v.sdf
    3809 2020-05-08 17:41 test/pdb_ligands_sdf/1yhj_r6c.sdf
    4892 2020-05-08 17:41 test/pdb_ligands_sdf/5ftg_nbr.sdf
    1844 2020-05-08 17:41 test/pdb_ligands_sdf/1ft7_plu.sdf
    3978 2020-05-08 17:41 test/pdb_ligands_sdf/3ws8_x4c.sdf
    3506 2020-05-08 17:41 test/pdb_ligands_sdf/4uvu_u1t.sdf
    5303 2020-05-08 17:41 test/pdb_ligands_sdf/5lx3_7a1.sdf
    1354 2020-05-08 17:41 test/pdb_ligands_sdf/2jhg_ibo.sdf
    2819 2020-05-08 17:41 test/pdb_ligands_sdf/4yma_4e5.sdf
    2540 2020-05-08 17:41 test/pdb_ligands_sdf/3wd4_qub.sdf
    4777 2020-05-08 17:41 test/pdb_ligands_sdf/1xzq_fon.sdf
    6252 2020-05-08 17:41 test/pdb_ligands_sdf/5i9i_5hv.sdf
    3272 2020-05-08 17:41 test/pdb_ligands_sdf/2xp8_4fy.sdf
    3186 2020-05-08 17:41 test/pdb_ligands_sdf/5kir_rcx.sdf
    3192 2020-05-08 17:41 test/pdb_ligands_sdf/3fv2_ndz.sdf
    4924 2020-05-08 17:41 test/pdb_ligands_sdf/2x4z_x4z.sdf
    3342 2020-05-08 17:41 test/pdb_ligands_sdf/3lhz_bmq.sdf
    2898 2020-05-08 17:41 test/pdb_ligands_sdf/5dgs_5a7.sdf
    3886 2020-05-08 17:41 test/pdb_ligands_sdf/4j5d_728.sdf
    2795 2020-05-08 17:41 test/pdb_ligands_sdf/5npc_94e.sdf
    3383 2020-05-08 17:41 test/pdb_ligands_sdf/5vup_9p4.sdf
    4013 2020-05-08 17:41 test/pdb_ligands_sdf/4ty1_38w.sdf
    3697 2020-05-08 17:41 test/pdb_ligands_sdf/3frg_sk4.sdf
    1703 2020-05-08 17:41 test/pdb_ligands_sdf/1aek_idm.sdf
    3601 2020-05-08 17:41 test/pdb_ligands_sdf/2r7b_253.sdf
    3324 2020-05-08 17:41 test/pdb_ligands_sdf/2zdx_p4a.sdf
    4070 2020-05-08 17:41 test/pdb_ligands_sdf/5v8n_8zp.sdf
    3417 2020-05-08 17:41 test/pdb_ligands_sdf/1tlc_dgp.sdf
    4424 2020-05-08 17:41 test/pdb_ligands_sdf/4kko_1re.sdf
    2113 2020-05-08 17:41 test/pdb_ligands_sdf/3etr_luz.sdf
    4257 2020-05-08 17:41 test/pdb_ligands_sdf/4ans_vgh.sdf
    2170 2020-05-08 17:41 test/pdb_ligands_sdf/1bgg_gco.sdf
    3706 2020-05-08 17:41 test/pdb_ligands_sdf/1akc_ppe.sdf
    4294 2020-05-08 17:41 test/pdb_ligands_sdf/4ngn_j96.sdf
    5275 2020-05-08 17:41 test/pdb_ligands_sdf/4bfw_zvw.sdf
    3112 2020-05-08 17:41 test/pdb_ligands_sdf/6egu_43y.sdf
    3472 2020-05-08 17:41 test/pdb_ligands_sdf/4kuv_mb6.sdf
    3732 2020-05-08 17:41 test/pdb_ligands_sdf/4gk3_l87.sdf
    2845 2020-05-08 17:41 test/pdb_ligands_sdf/4qa0_shh.sdf
    4216 2020-05-08 17:41 test/pdb_ligands_sdf/3g9n_j88.sdf
    4398 2020-05-08 17:41 test/pdb_ligands_sdf/2ds1_1cd.sdf
    1825 2020-05-08 17:41 test/pdb_ligands_sdf/3fuh_5h1.sdf
    1952 2020-05-08 17:41 test/pdb_ligands_sdf/2pvv_ose.sdf
    7106 2020-05-08 17:41 test/pdb_ligands_sdf/3inq_x0j.sdf
    4303 2020-05-08 17:41 test/pdb_ligands_sdf/4xve_wds.sdf
    3553 2020-05-08 17:41 test/pdb_ligands_sdf/4ea2_rwz.sdf
    2278 2020-05-08 17:41 test/pdb_ligands_sdf/2or4_qus.sdf
    5764 2020-05-08 17:41 test/pdb_ligands_sdf/5iez_6al.sdf
    3990 2020-05-08 17:41 test/pdb_ligands_sdf/4p4i_2g5.sdf
    4151 2020-05-08 17:41 test/pdb_ligands_sdf/5ei4_5nv.sdf
    3760 2020-05-08 17:41 test/pdb_ligands_sdf/4zl1_18x.sdf
    2986 2020-05-08 17:41 test/pdb_ligands_sdf/3owk_18e.sdf
    1940 2020-05-08 17:41 test/pdb_ligands_sdf/3imc_bz3.sdf
    2420 2020-05-08 17:41 test/pdb_ligands_sdf/1lt8_cbh.sdf
    3821 2020-05-08 17:41 test/pdb_ligands_sdf/3df9_df9.sdf
    3010 2020-05-08 17:41 test/pdb_ligands_sdf/5ih5_aue.sdf
    3935 2020-05-08 17:41 test/pdb_ligands_sdf/3fmz_2t1.sdf
    2548 2020-05-08 17:41 test/pdb_ligands_sdf/5lu9_3y7.sdf
    1856 2020-05-08 17:41 test/pdb_ligands_sdf/2gyi_hya.sdf
    1949 2020-05-08 17:41 test/pdb_ligands_sdf/5aqs_1sq.sdf
    4723 2020-05-08 17:41 test/pdb_ligands_sdf/2rg6_287.sdf
    1971 2020-05-08 17:41 test/pdb_ligands_sdf/3u2x_aso.sdf
    3696 2020-05-08 17:41 test/pdb_ligands_sdf/2ea4_f79.sdf
    4959 2020-05-08 17:41 test/pdb_ligands_sdf/2i3i_618.sdf
    1954 2020-05-08 17:41 test/pdb_ligands_sdf/3urq_qmp.sdf
    5787 2020-05-08 17:41 test/pdb_ligands_sdf/1xh5_r68.sdf
    3275 2020-05-08 17:41 test/pdb_ligands_sdf/5f3e_5uo.sdf
    8203 2020-05-08 17:41 test/pdb_ligands_sdf/1qz5_kab.sdf
    2202 2020-05-08 17:41 test/pdb_ligands_sdf/5mam_sro.sdf
    2381 2020-05-08 17:41 test/pdb_ligands_sdf/4mgi_cmp.sdf
    4068 2020-05-08 17:41 test/pdb_ligands_sdf/4res_buf.sdf
    6183 2020-05-08 17:41 test/pdb_ligands_sdf/3nam_pty.sdf
    3047 2020-05-08 17:41 test/pdb_ligands_sdf/1q92_drm.sdf
    2509 2020-05-08 17:41 test/pdb_ligands_sdf/4jh7_1km.sdf
    7774 2020-05-08 17:41 test/pdb_ligands_sdf/3ric_cis.sdf
    4480 2020-05-08 17:41 test/pdb_ligands_sdf/5jfv_6k1.sdf
    4212 2020-05-08 17:41 test/pdb_ligands_sdf/3vs0_vs0.sdf
    1841 2020-05-08 17:41 test/pdb_ligands_sdf/2fpz_270.sdf
    1947 2020-05-08 17:41 test/pdb_ligands_sdf/1v2h_gun.sdf
    2671 2020-05-08 17:41 test/pdb_ligands_sdf/5ot8_6db.sdf
    3546 2020-05-08 17:41 test/pdb_ligands_sdf/3mu6_bxl.sdf
    1952 2020-05-08 17:41 test/pdb_ligands_sdf/5ofw_9tw.sdf
    4618 2020-05-08 17:41 test/pdb_ligands_sdf/4bcf_t6q.sdf
    8482 2020-05-08 17:41 test/pdb_ligands_sdf/4dh0_mr8.sdf
    1814 2020-05-08 17:41 test/pdb_ligands_sdf/1an9_be2.sdf
    4272 2020-05-08 17:41 test/pdb_ligands_sdf/5t92_77w.sdf
    3078 2020-05-08 17:41 test/pdb_ligands_sdf/4gqi_m49.sdf
    2036 2020-05-08 17:41 test/pdb_ligands_sdf/2zb4_5op.sdf
    4609 2020-05-08 17:41 test/pdb_ligands_sdf/4l52_1ul.sdf
    3983 2020-05-08 17:41 test/pdb_ligands_sdf/4wa9_axi.sdf
    3924 2020-05-08 17:41 test/pdb_ligands_sdf/4clz_4ds.sdf
    2835 2020-05-08 17:41 test/pdb_ligands_sdf/3dpd_41a.sdf
    2341 2020-05-08 17:41 test/pdb_ligands_sdf/3hch_rsm.sdf
    4316 2020-05-08 17:41 test/pdb_ligands_sdf/3s92_jq1.sdf
    1920 2020-05-08 17:41 test/pdb_ligands_sdf/3lmx_dhb.sdf
    4839 2020-05-08 17:41 test/pdb_ligands_sdf/5fbl_5w9.sdf
    4997 2020-05-08 17:41 test/pdb_ligands_sdf/4ia1_biv.sdf
    5063 2020-05-08 17:41 test/pdb_ligands_sdf/3e7c_866.sdf
    5699 2020-05-08 17:41 test/pdb_ligands_sdf/4y8x_4gr.sdf
    6093 2020-05-08 17:41 test/pdb_ligands_sdf/5unf_8es.sdf
    3586 2020-05-08 17:41 test/pdb_ligands_sdf/3lm1_lec.sdf
    3638 2020-05-08 17:41 test/pdb_ligands_sdf/3w86_w86.sdf
    5335 2020-05-08 17:41 test/pdb_ligands_sdf/4x7n_3z5.sdf
    3500 2020-05-08 17:41 test/pdb_ligands_sdf/5x72_p69.sdf
    2623 2020-05-08 17:41 test/pdb_ligands_sdf/5af9_sjr.sdf
    4944 2020-05-08 17:41 test/pdb_ligands_sdf/4oq5_2uu.sdf
    4056 2020-05-08 17:41 test/pdb_ligands_sdf/1o37_653.sdf
    3121 2020-05-08 17:41 test/pdb_ligands_sdf/1rti_hef.sdf
    3861 2020-05-08 17:41 test/pdb_ligands_sdf/6btw_e8d.sdf
    4309 2020-05-08 17:41 test/pdb_ligands_sdf/1x1j_46d.sdf
    4071 2020-05-08 17:41 test/pdb_ligands_sdf/4f4p_0sb.sdf
    4459 2020-05-08 17:41 test/pdb_ligands_sdf/1qbn_688.sdf
    3668 2020-05-08 17:41 test/pdb_ligands_sdf/3t1l_mqt.sdf
    1551 2020-05-08 17:41 test/pdb_ligands_sdf/3gn0_dmo.sdf
    2637 2020-05-08 17:41 test/pdb_ligands_sdf/3mv5_xfe.sdf
    4189 2020-05-08 17:41 test/pdb_ligands_sdf/3g0e_b49.sdf
    3239 2020-05-08 17:41 test/pdb_ligands_sdf/1opm_iyg.sdf
    3952 2020-05-08 17:41 test/pdb_ligands_sdf/1yvz_jpc.sdf
    4947 2020-05-08 17:41 test/pdb_ligands_sdf/4o6l_2qk.sdf
    6677 2020-05-08 17:41 test/pdb_ligands_sdf/5qca_bgj.sdf
    3652 2020-05-08 17:41 test/pdb_ligands_sdf/1v7a_frc.sdf
    1927 2020-05-08 17:41 test/pdb_ligands_sdf/3r49_q8a.sdf
    4626 2020-05-08 17:41 test/pdb_ligands_sdf/2pj3_86a.sdf
    3447 2020-05-08 17:41 test/pdb_ligands_sdf/3kox_z98.sdf
    3100 2020-05-08 17:41 test/pdb_ligands_sdf/4imf_si3.sdf
    8628 2020-05-08 17:41 test/pdb_ligands_sdf/3nan_hz1.sdf
    2084 2020-05-08 17:41 test/pdb_ligands_sdf/5jzs_fgz.sdf
    5807 2020-05-08 17:41 test/pdb_ligands_sdf/4yur_4j7.sdf
    2381 2020-05-08 17:41 test/pdb_ligands_sdf/1v08_ntz.sdf
    2055 2020-05-08 17:41 test/pdb_ligands_sdf/3ms9_ms9.sdf
    3413 2020-05-08 17:41 test/pdb_ligands_sdf/5nrd_lat.sdf
    4236 2020-05-08 17:41 test/pdb_ligands_sdf/1ykr_628.sdf
    4624 2020-05-08 17:41 test/pdb_ligands_sdf/5owr_1n1.sdf
    3479 2020-05-08 17:41 test/pdb_ligands_sdf/3hdm_mmg.sdf
    2340 2020-05-08 17:41 test/pdb_ligands_sdf/4tyl_39o.sdf
    4473 2020-05-08 17:41 test/pdb_ligands_sdf/2wxo_zzp.sdf
    3019 2020-05-08 17:41 test/pdb_ligands_sdf/4rbl_3o7.sdf
    4061 2020-05-08 17:41 test/pdb_ligands_sdf/2pq9_gg9.sdf
    4765 2020-05-08 17:41 test/pdb_ligands_sdf/3a40_23r.sdf
    2829 2020-05-08 17:41 test/pdb_ligands_sdf/2cn8_dbq.sdf
    1686 2020-05-08 17:41 test/pdb_ligands_sdf/2inx_ffp.sdf
    4606 2020-05-08 17:41 test/pdb_ligands_sdf/4ibc_12g.sdf
    1632 2020-05-08 17:41 test/pdb_ligands_sdf/3i8r_dtv.sdf
    4222 2020-05-08 17:41 test/pdb_ligands_sdf/5q1i_9o1.sdf
    6626 2020-05-08 17:41 test/pdb_ligands_sdf/1gzp_gm2.sdf
    5195 2020-05-08 17:41 test/pdb_ligands_sdf/5v8v_90d.sdf
    2256 2020-05-08 17:41 test/pdb_ligands_sdf/4gui_qic.sdf
    5175 2020-05-08 17:41 test/pdb_ligands_sdf/3ccz_5hi.sdf
    3264 2020-05-08 17:41 test/pdb_ligands_sdf/1y6r_mtm.sdf
    2208 2020-05-08 17:41 test/pdb_ligands_sdf/3kbo_ndb.sdf
    3159 2020-05-08 17:41 test/pdb_ligands_sdf/4tr9_38d.sdf
    4101 2020-05-08 17:41 test/pdb_ligands_sdf/4zqo_q67.sdf
    2168 2020-05-08 17:41 test/pdb_ligands_sdf/3dp8_hct.sdf
    2042 2020-05-08 17:41 test/pdb_ligands_sdf/5cuc_54w.sdf
    1925 2020-05-08 17:41 test/pdb_ligands_sdf/3crb_cou.sdf
    2936 2020-05-08 17:41 test/pdb_ligands_sdf/4da0_gng.sdf
    4534 2020-05-08 17:41 test/pdb_ligands_sdf/4mgy_h07.sdf
    4152 2020-05-08 17:41 test/pdb_ligands_sdf/4pk5_pkj.sdf
    3747 2020-05-08 17:41 test/pdb_ligands_sdf/3n5v_xfh.sdf
    4729 2020-05-08 17:41 test/pdb_ligands_sdf/4tmf_js2.sdf
    4776 2020-05-08 17:41 test/pdb_ligands_sdf/5fpf_5zi.sdf
    2912 2020-05-08 17:41 test/pdb_ligands_sdf/4jts_jts.sdf
    3809 2020-05-08 17:41 test/pdb_ligands_sdf/5hct_61p.sdf
    1967 2020-05-08 17:41 test/pdb_ligands_sdf/4hsl_3ha.sdf
    2589 2020-05-08 17:41 test/pdb_ligands_sdf/3t4l_zea.sdf
    5982 2020-05-08 17:41 test/pdb_ligands_sdf/1a72_pad.sdf
    2921 2020-05-08 17:41 test/pdb_ligands_sdf/3l3l_l3l.sdf
    1983 2020-05-08 17:41 test/pdb_ligands_sdf/1hxk_dmj.sdf
    3521 2020-05-08 17:41 test/pdb_ligands_sdf/5up3_8gs.sdf
    5335 2020-05-08 17:41 test/pdb_ligands_sdf/2i4u_djr.sdf
    3352 2020-05-08 17:41 test/pdb_ligands_sdf/4bo2_36k.sdf
    4107 2020-05-08 17:41 test/pdb_ligands_sdf/4ojb_198.sdf
    2769 2020-05-08 17:41 test/pdb_ligands_sdf/1yds_iqs.sdf
    3951 2020-05-08 17:41 test/pdb_ligands_sdf/5two_7mv.sdf
    3938 2020-05-08 17:41 test/pdb_ligands_sdf/5kmk_6ug.sdf
    1847 2020-05-08 17:41 test/pdb_ligands_sdf/3kqo_es4.sdf
    3615 2020-05-08 17:41 test/pdb_ligands_sdf/4q9o_2zw.sdf
    3283 2020-05-08 17:41 test/pdb_ligands_sdf/2z68_til.sdf
    3539 2020-05-08 17:41 test/pdb_ligands_sdf/4lzj_22h.sdf
    4507 2020-05-08 17:41 test/pdb_ligands_sdf/5n2x_8kn.sdf
    1809 2020-05-08 17:41 test/pdb_ligands_sdf/3pcb_3hb.sdf
    2426 2020-05-08 17:41 test/pdb_ligands_sdf/5o0c_9f8.sdf
    3896 2020-05-08 17:41 test/pdb_ligands_sdf/3mq4_z99.sdf
    3508 2020-05-08 17:41 test/pdb_ligands_sdf/5tc5_big.sdf
    3350 2020-05-08 17:41 test/pdb_ligands_sdf/5ai9_k78.sdf
    3613 2020-05-08 17:41 test/pdb_ligands_sdf/5ggl_6zc.sdf
    4158 2020-05-08 17:41 test/pdb_ligands_sdf/4ewq_mwl.sdf
    2942 2020-05-08 17:41 test/pdb_ligands_sdf/3f18_hs5.sdf
    3248 2020-05-08 17:41 test/pdb_ligands_sdf/5auy_mri.sdf
    3468 2020-05-08 17:41 test/pdb_ligands_sdf/4kuw_mb2.sdf
    3259 2020-05-08 17:41 test/pdb_ligands_sdf/5mft_7mf.sdf
    3648 2020-05-08 17:41 test/pdb_ligands_sdf/4bnx_o74.sdf
    5145 2020-05-08 17:41 test/pdb_ligands_sdf/5div_5bh.sdf
    2582 2020-05-08 17:41 test/pdb_ligands_sdf/4mk2_28b.sdf
    2911 2020-05-08 17:41 test/pdb_ligands_sdf/3t44_igp.sdf
    2847 2020-05-08 17:41 test/pdb_ligands_sdf/2vpp_geo.sdf
    4148 2020-05-08 17:41 test/pdb_ligands_sdf/5q0t_9lm.sdf
    3956 2020-05-08 17:41 test/pdb_ligands_sdf/2xp9_4g8.sdf
    6610 2020-05-08 17:41 test/pdb_ligands_sdf/4f45_dn4.sdf
    4745 2020-05-08 17:41 test/pdb_ligands_sdf/4afe_ggy.sdf
    6038 2020-05-08 17:41 test/pdb_ligands_sdf/1qgl_ejt.sdf
    4093 2020-05-08 17:41 test/pdb_ligands_sdf/5drt_5eg.sdf
    4094 2020-05-08 17:41 test/pdb_ligands_sdf/3mnp_dex.sdf
    3238 2020-05-08 17:41 test/pdb_ligands_sdf/5djp_5bj.sdf
    1582 2020-05-08 17:41 test/pdb_ligands_sdf/1nht_hda.sdf
    2903 2020-05-08 17:41 test/pdb_ligands_sdf/5fl1_dv1.sdf
    5294 2020-05-08 17:41 test/pdb_ligands_sdf/4ksp_1su.sdf
    4666 2020-05-08 17:41 test/pdb_ligands_sdf/5bvd_4vf.sdf
    4578 2020-05-08 17:41 test/pdb_ligands_sdf/4n4t_2gv.sdf
    3386 2020-05-08 17:41 test/pdb_ligands_sdf/4fsm_hk1.sdf
    2078 2020-05-08 17:41 test/pdb_ligands_sdf/2o51_fru.sdf
    3510 2020-05-08 17:41 test/pdb_ligands_sdf/3ozv_ecn.sdf
    2443 2020-05-08 17:41 test/pdb_ligands_sdf/2cm8_f16.sdf
    4270 2020-05-08 17:41 test/pdb_ligands_sdf/2a9w_ga9.sdf
    3023 2020-05-08 17:41 test/pdb_ligands_sdf/5ehy_5o4.sdf
    5364 2020-05-08 17:41 test/pdb_ligands_sdf/1w7x_413.sdf
    4091 2020-05-08 17:41 test/pdb_ligands_sdf/1frb_zst.sdf
    3515 2020-05-08 17:41 test/pdb_ligands_sdf/4iqt_1fo.sdf
    6247 2020-05-08 17:41 test/pdb_ligands_sdf/2xcf_bbq.sdf
    5266 2020-05-08 17:41 test/pdb_ligands_sdf/2ayw_ono.sdf
    5004 2020-05-08 17:41 test/pdb_ligands_sdf/3cvk_n34.sdf
    2836 2020-05-08 17:41 test/pdb_ligands_sdf/3dgq_eaa.sdf
    3688 2020-05-08 17:41 test/pdb_ligands_sdf/5e19_5k7.sdf
    4907 2020-05-08 17:41 test/pdb_ligands_sdf/1zrb_062.sdf
    3750 2020-05-08 17:41 test/pdb_ligands_sdf/5vt1_9js.sdf
    2010 2020-05-08 17:41 test/pdb_ligands_sdf/4whq_3n9.sdf
    3662 2020-05-08 17:41 test/pdb_ligands_sdf/3ejs_hn5.sdf
    3900 2020-05-08 17:41 test/pdb_ligands_sdf/4cty_s5d.sdf
    4862 2020-05-08 17:41 test/pdb_ligands_sdf/2gst_gps.sdf
    5596 2020-05-08 17:41 test/pdb_ligands_sdf/3o5x_jzg.sdf
    3629 2020-05-08 17:41 test/pdb_ligands_sdf/1xom_cio.sdf
    4465 2020-05-08 17:41 test/pdb_ligands_sdf/3v5j_0f2.sdf
    2689 2020-05-08 17:41 test/pdb_ligands_sdf/5aom_fy8.sdf
    4485 2020-05-08 17:41 test/pdb_ligands_sdf/4i2q_1bt.sdf
    3903 2020-05-08 17:41 test/pdb_ligands_sdf/4ctr_s20.sdf
    3115 2020-05-08 17:41 test/pdb_ligands_sdf/4i8v_bhf.sdf
    4700 2020-05-08 17:41 test/pdb_ligands_sdf/5kny_ypg.sdf
    2476 2020-05-08 17:41 test/pdb_ligands_sdf/4y41_46o.sdf
    4286 2020-05-08 17:41 test/pdb_ligands_sdf/4cj3_e4f.sdf
    3898 2020-05-08 17:41 test/pdb_ligands_sdf/1utt_cp8.sdf
    4541 2020-05-08 17:41 test/pdb_ligands_sdf/4dtc_d5c.sdf
    3822 2020-05-08 17:41 test/pdb_ligands_sdf/1d3g_bre.sdf
    5539 2020-05-08 17:41 test/pdb_ligands_sdf/3g82_mi3.sdf
    3128 2020-05-08 17:41 test/pdb_ligands_sdf/7std_crp.sdf
    3107 2020-05-08 17:41 test/pdb_ligands_sdf/4bud_29f.sdf
    1928 2020-05-08 17:41 test/pdb_ligands_sdf/2vpn_4cs.sdf
    3024 2020-05-08 17:41 test/pdb_ligands_sdf/2ikg_bto.sdf
    3882 2020-05-08 17:41 test/pdb_ligands_sdf/4fkr_45k.sdf
    2388 2020-05-08 17:41 test/pdb_ligands_sdf/5o1n_9h8.sdf
    4317 2020-05-08 17:41 test/pdb_ligands_sdf/4bw1_s5b.sdf
    3113 2020-05-08 17:41 test/pdb_ligands_sdf/5ox6_a1z.sdf
    3605 2020-05-08 17:41 test/pdb_ligands_sdf/2nx3_1nt.sdf
    4234 2020-05-08 17:41 test/pdb_ligands_sdf/4lsl_1yq.sdf
    3656 2020-05-08 17:41 test/pdb_ligands_sdf/5tbo_78z.sdf
    3254 2020-05-08 17:41 test/pdb_ligands_sdf/5a7o_7wh.sdf
    3363 2020-05-08 17:41 test/pdb_ligands_sdf/3da2_4md.sdf
    5497 2020-05-08 17:41 test/pdb_ligands_sdf/4ews_0rp.sdf
    3441 2020-05-08 17:41 test/pdb_ligands_sdf/5knq_6w8.sdf
    4370 2020-05-08 17:41 test/pdb_ligands_sdf/5kcc_ob1.sdf
    3305 2020-05-08 17:41 test/pdb_ligands_sdf/4ql8_jad.sdf
    2637 2020-05-08 17:41 test/pdb_ligands_sdf/3qsa_ta7.sdf
    1813 2020-05-08 17:41 test/pdb_ligands_sdf/2itm_xul.sdf
    3896 2020-05-08 17:41 test/pdb_ligands_sdf/3gc4_aaq.sdf
    2629 2020-05-08 17:41 test/pdb_ligands_sdf/3rts_klg.sdf
    1971 2020-05-08 17:41 test/pdb_ligands_sdf/3n31_fca.sdf
    8036 2020-05-08 17:41 test/pdb_ligands_sdf/4drj_rap.sdf
    4168 2020-05-08 17:41 test/pdb_ligands_sdf/5vub_8gu.sdf
    3907 2020-05-08 17:41 test/pdb_ligands_sdf/5p9o_7jf.sdf
    4690 2020-05-08 17:41 test/pdb_ligands_sdf/4kfp_1r7.sdf
    2110 2020-05-08 17:41 test/pdb_ligands_sdf/5ug2_86j.sdf
    2942 2020-05-08 17:41 test/pdb_ligands_sdf/5d7x_xz8.sdf
    3549 2020-05-08 17:41 test/pdb_ligands_sdf/5t36_755.sdf
    4440 2020-05-08 17:41 test/pdb_ligands_sdf/4ja8_1k9.sdf
    2297 2020-05-08 17:41 test/pdb_ligands_sdf/2gwc_bsc.sdf
    3743 2020-05-08 17:41 test/pdb_ligands_sdf/4yad_4a7.sdf
    3472 2020-05-08 17:41 test/pdb_ligands_sdf/3ex8_aif.sdf
    1747 2020-05-08 17:41 test/pdb_ligands_sdf/3mct_3mc.sdf
    2324 2020-05-08 17:41 test/pdb_ligands_sdf/2j5v_rgp.sdf
    3263 2020-05-08 17:41 test/pdb_ligands_sdf/2zjw_ref.sdf
    3457 2020-05-08 17:41 test/pdb_ligands_sdf/4d34_e2z.sdf
    2653 2020-05-08 17:41 test/pdb_ligands_sdf/4p75_2nm.sdf
    1945 2020-05-08 17:41 test/pdb_ligands_sdf/5c87_4ys.sdf
    4001 2020-05-08 17:41 test/pdb_ligands_sdf/4mq6_29w.sdf
    3199 2020-05-08 17:41 test/pdb_ligands_sdf/5xt6_pda.sdf
    4489 2020-05-08 17:41 test/pdb_ligands_sdf/4zud_olm.sdf
    3411 2020-05-08 17:41 test/pdb_ligands_sdf/4jv8_1m1.sdf
    4792 2020-05-08 17:41 test/pdb_ligands_sdf/1jwt_bli.sdf
    1820 2020-05-08 17:41 test/pdb_ligands_sdf/3r59_3ao.sdf
    6558 2020-05-08 17:41 test/pdb_ligands_sdf/2h26_6pl.sdf
    3919 2020-05-08 17:41 test/pdb_ligands_sdf/4qr5_bnm.sdf
    5499 2020-05-08 17:41 test/pdb_ligands_sdf/3wsp_w09.sdf
    4259 2020-05-08 17:41 test/pdb_ligands_sdf/4tqc_34j.sdf
    3718 2020-05-08 17:41 test/pdb_ligands_sdf/4a9r_ru5.sdf
    3551 2020-05-08 17:41 test/pdb_ligands_sdf/2x2r_x2o.sdf
    2797 2020-05-08 17:41 test/pdb_ligands_sdf/3p3t_3m3.sdf
    3939 2020-05-08 17:41 test/pdb_ligands_sdf/3c6u_m22.sdf
    2719 2020-05-08 17:41 test/pdb_ligands_sdf/3t2v_kkj.sdf
    4610 2020-05-08 17:41 test/pdb_ligands_sdf/2hiw_7mp.sdf
    3902 2020-05-08 17:41 test/pdb_ligands_sdf/4kpe_af5.sdf
    3336 2020-05-08 17:41 test/pdb_ligands_sdf/5buj_4vb.sdf
    2101 2020-05-08 17:41 test/pdb_ligands_sdf/4h2h_0xw.sdf
    1865 2020-05-08 17:41 test/pdb_ligands_sdf/4qee_z6j.sdf
    4812 2020-05-08 17:41 test/pdb_ligands_sdf/3wt5_ya1.sdf
    4079 2020-05-08 17:41 test/pdb_ligands_sdf/4xjm_41e.sdf
    2324 2020-05-08 17:41 test/pdb_ligands_sdf/2aie_sb9.sdf
    3567 2020-05-08 17:41 test/pdb_ligands_sdf/5awa_m8d.sdf
    2425 2020-05-08 17:41 test/pdb_ligands_sdf/1g9a_bab.sdf
    1453 2020-05-08 17:41 test/pdb_ligands_sdf/1f9o_pih.sdf
    4168 2020-05-08 17:41 test/pdb_ligands_sdf/5wny_b7p.sdf
    4938 2020-05-08 17:41 test/pdb_ligands_sdf/4x8c_3yz.sdf
    3845 2020-05-08 17:41 test/pdb_ligands_sdf/4byj_fh5.sdf
    3928 2020-05-08 17:41 test/pdb_ligands_sdf/5jnw_6lj.sdf
    5064 2020-05-08 17:41 test/pdb_ligands_sdf/2xpc_051.sdf
    4049 2020-05-08 17:41 test/pdb_ligands_sdf/4mcb_21w.sdf
    5314 2020-05-08 17:41 test/pdb_ligands_sdf/3bqd_day.sdf
    4770 2020-05-08 17:41 test/pdb_ligands_sdf/1rcj_ma4.sdf
    5113 2020-05-08 17:41 test/pdb_ligands_sdf/4zg7_4o0.sdf
    4233 2020-05-08 17:41 test/pdb_ligands_sdf/1hwr_216.sdf
    5160 2020-05-08 17:41 test/pdb_ligands_sdf/3omm_omm.sdf
    1813 2020-05-08 17:41 test/pdb_ligands_sdf/2isf_pac.sdf
    3603 2020-05-08 17:41 test/pdb_ligands_sdf/5mk4_i5w.sdf
    4599 2020-05-08 17:41 test/pdb_ligands_sdf/4xs2_42p.sdf
    3961 2020-05-08 17:41 test/pdb_ligands_sdf/5dyy_5hh.sdf
    5648 2020-05-08 17:41 test/pdb_ligands_sdf/5m1e_7d9.sdf
    5609 2020-05-08 17:41 test/pdb_ligands_sdf/4r4q_3hz.sdf
    2094 2020-05-08 17:41 test/pdb_ligands_sdf/4x0m_3wa.sdf
    2977 2020-05-08 17:41 test/pdb_ligands_sdf/5wrz_7u3.sdf
    3937 2020-05-08 17:41 test/pdb_ligands_sdf/5wiv_aqd.sdf
    3336 2020-05-08 17:41 test/pdb_ligands_sdf/1uv5_brw.sdf
    2434 2020-05-08 17:41 test/pdb_ligands_sdf/4n9b_2hh.sdf
    5751 2020-05-08 17:41 test/pdb_ligands_sdf/4lxb_7r9.sdf
    4101 2020-05-08 17:41 test/pdb_ligands_sdf/1d8m_bbh.sdf
    3973 2020-05-08 17:41 test/pdb_ligands_sdf/2fsz_oht.sdf
    3098 2020-05-08 17:41 test/pdb_ligands_sdf/1pmu_9hp.sdf
    4499 2020-05-08 17:41 test/pdb_ligands_sdf/5l2t_6zz.sdf
    3940 2020-05-08 17:41 test/pdb_ligands_sdf/5tzh_7op.sdf
    6470 2020-05-08 17:41 test/pdb_ligands_sdf/5ehq_5o2.sdf
    3289 2020-05-08 17:41 test/pdb_ligands_sdf/4be0_bf3.sdf
    3930 2020-05-08 17:41 test/pdb_ligands_sdf/1z2o_i4p.sdf
    2587 2020-05-08 17:41 test/pdb_ligands_sdf/5uep_88p.sdf
    4440 2020-05-08 17:41 test/pdb_ligands_sdf/4d08_q2t.sdf
    3853 2020-05-08 17:41 test/pdb_ligands_sdf/1fcz_156.sdf
    3482 2020-05-08 17:41 test/pdb_ligands_sdf/2oph_277.sdf
    4041 2020-05-08 17:41 test/pdb_ligands_sdf/3uft_hw7.sdf
    3883 2020-05-08 17:41 test/pdb_ligands_sdf/4wko_hce.sdf
    2872 2020-05-08 17:41 test/pdb_ligands_sdf/4mk7_28o.sdf
    3213 2020-05-08 17:41 test/pdb_ligands_sdf/4ln7_1zq.sdf
    4590 2020-05-08 17:41 test/pdb_ligands_sdf/4izy_1j2.sdf
    4758 2020-05-08 17:41 test/pdb_ligands_sdf/3t9c_ihp.sdf
    3040 2020-05-08 17:41 test/pdb_ligands_sdf/5ufj_86m.sdf
    3193 2020-05-08 17:41 test/pdb_ligands_sdf/2bvd_isx.sdf
    2551 2020-05-08 17:41 test/pdb_ligands_sdf/2zas_1oh.sdf
    4620 2020-05-08 17:41 test/pdb_ligands_sdf/4umz_xjo.sdf
    3431 2020-05-08 17:41 test/pdb_ligands_sdf/4l1w_str.sdf
    1521 2020-05-08 17:41 test/pdb_ligands_sdf/1h4q_pri.sdf
    2489 2020-05-08 17:41 test/pdb_ligands_sdf/3uwe_vjj.sdf
    2903 2020-05-08 17:41 test/pdb_ligands_sdf/1xor_zar.sdf
      dir 2020-05-08 17:41 test/pdb_ligands_sdf/rdkit_addh/
    3886 2020-05-08 17:41 test/pdb_ligands_sdf/5b7v_lwj.sdf
    3536 2020-05-08 17:41 test/pdb_ligands_sdf/3gb2_g3b.sdf
    3776 2020-05-08 17:41 test/pdb_ligands_sdf/3gok_p4o.sdf
    3703 2020-05-08 17:41 test/pdb_ligands_sdf/1x8t_rc1.sdf
    4694 2020-05-08 17:41 test/pdb_ligands_sdf/3cem_avd.sdf
    3884 2020-05-08 17:41 test/pdb_ligands_sdf/5mhq_8qt.sdf
    4350 2020-05-08 17:41 test/pdb_ligands_sdf/4rce_3ln.sdf
    4287 2020-05-08 17:41 test/pdb_ligands_sdf/5dw1_5gd.sdf
    3391 2020-05-08 17:41 test/pdb_ligands_sdf/5m4i_7fc.sdf
    4737 2020-05-08 17:41 test/pdb_ligands_sdf/3bym_am0.sdf
    5291 2020-05-08 17:41 test/pdb_ligands_sdf/3e4a_qix.sdf
    4298 2020-05-08 17:41 test/pdb_ligands_sdf/5d3r_57c.sdf
    1976 2020-05-08 17:41 test/pdb_ligands_sdf/2h0t_tem.sdf
    4634 2020-05-08 17:41 test/pdb_ligands_sdf/3hfb_ml4.sdf
    3451 2020-05-08 17:41 test/pdb_ligands_sdf/3g0x_md7.sdf
    4202 2020-05-08 17:41 test/pdb_ligands_sdf/2a3y_cpj.sdf
    2455 2020-05-08 17:41 test/pdb_ligands_sdf/4dhl_0k7.sdf
    4228 2020-05-08 17:41 test/pdb_ligands_sdf/3uh0_tsb.sdf
    1706 2020-05-08 17:41 test/pdb_ligands_sdf/4yjf_98b.sdf
    3577 2020-05-08 17:41 test/pdb_ligands_sdf/3ppm_jg1.sdf
    4896 2020-05-08 17:41 test/pdb_ligands_sdf/4mia_28l.sdf
    3531 2020-05-08 17:41 test/pdb_ligands_sdf/3a73_pj2.sdf
    4891 2020-05-08 17:41 test/pdb_ligands_sdf/5uwk_8om.sdf
    2422 2020-05-08 17:41 test/pdb_ligands_sdf/5lvr_78y.sdf
    3877 2020-05-08 17:41 test/pdb_ligands_sdf/5d1t_56r.sdf
    5026 2020-05-08 17:41 test/pdb_ligands_sdf/5ebt_5n8.sdf
    1925 2020-05-08 17:41 test/pdb_ligands_sdf/4f92_san.sdf
    2425 2020-05-08 17:41 test/pdb_ligands_sdf/4ucr_jcf.sdf
    2410 2020-05-08 17:41 test/pdb_ligands_sdf/5nn6_mig.sdf
    3290 2020-05-08 17:41 test/pdb_ligands_sdf/1cq6_py4.sdf
    3664 2020-05-08 17:41 test/pdb_ligands_sdf/2x0h_14t.sdf
    4079 2020-05-08 17:41 test/pdb_ligands_sdf/4fr1_0v2.sdf
    1979 2020-05-08 17:41 test/pdb_ligands_sdf/4k60_1p8.sdf
    3431 2020-05-08 17:41 test/pdb_ligands_sdf/4f63_0s7.sdf
    3299 2020-05-08 17:41 test/pdb_ligands_sdf/4wml_ppc.sdf
    4026 2020-05-08 17:41 test/pdb_ligands_sdf/4hgs_15g.sdf
    3780 2020-05-08 17:41 test/pdb_ligands_sdf/3apc_mmd.sdf
    5275 2020-05-08 17:41 test/pdb_ligands_sdf/5dy5_5gr.sdf
    3110 2020-05-08 17:41 test/pdb_ligands_sdf/4jvm_xdi.sdf
    5456 2020-05-08 17:41 test/pdb_ligands_sdf/4fc0_0t2.sdf
    4645 2020-05-08 17:41 test/pdb_ligands_sdf/1thz_326.sdf
    2100 2020-05-08 17:41 test/pdb_ligands_sdf/4cuu_y6m.sdf
    2831 2020-05-08 17:41 test/pdb_ligands_sdf/2etr_y27.sdf
    2653 2020-05-08 17:41 test/pdb_ligands_sdf/4uru_6w2.sdf
    2539 2020-05-08 17:41 test/pdb_ligands_sdf/1iy7_cxa.sdf
    4376 2020-05-08 17:41 test/pdb_ligands_sdf/3r8i_xcx.sdf
     905 2020-05-08 17:41 test/pdb_ligands_sdf/3q9e_sp5.sdf
    3421 2020-05-08 17:41 test/pdb_ligands_sdf/4p0x_1wo.sdf
    1972 2020-05-08 17:41 test/pdb_ligands_sdf/4ows_4m0.sdf
    4168 2020-05-08 17:41 test/pdb_ligands_sdf/4tyh_39g.sdf
    4474 2020-05-08 17:41 test/pdb_ligands_sdf/3kga_lx9.sdf
    1972 2020-05-08 17:41 test/pdb_ligands_sdf/2an4_otr.sdf
    3095 2020-05-08 17:41 test/pdb_ligands_sdf/1w6r_gnt.sdf
    3366 2020-05-08 17:41 test/pdb_ligands_sdf/1s3w_tqt.sdf
    4560 2020-05-08 17:41 test/pdb_ligands_sdf/1vj3_tab.sdf
    6545 2020-05-08 17:41 test/pdb_ligands_sdf/3uag_uma.sdf
    2498 2020-05-08 17:41 test/pdb_ligands_sdf/1mqg_iwd.sdf
    6674 2020-05-08 17:41 test/pdb_ligands_sdf/1rne_c60.sdf
    2576 2020-05-08 17:41 test/pdb_ligands_sdf/5hrv_64c.sdf
    3992 2020-05-08 17:41 test/pdb_ligands_sdf/3myq_e27.sdf
    1949 2020-05-08 17:41 test/pdb_ligands_sdf/1xym_glo.sdf
    3384 2020-05-08 17:41 test/pdb_ligands_sdf/5f0f_5td.sdf
    4788 2020-05-08 17:41 test/pdb_ligands_sdf/4whu_3ot.sdf
    2274 2020-05-08 17:41 test/pdb_ligands_sdf/4b0b_54f.sdf
    4369 2020-05-08 17:41 test/pdb_ligands_sdf/3fqk_79z.sdf
    3605 2020-05-08 17:41 test/pdb_ligands_sdf/3eai_328.sdf
    4358 2020-05-08 17:41 test/pdb_ligands_sdf/2ouz_c3d.sdf
    4182 2020-05-08 17:41 test/pdb_ligands_sdf/3ds6_a17.sdf
    4608 2020-05-08 17:41 test/pdb_ligands_sdf/5hes_032.sdf
    5137 2020-05-08 17:41 test/pdb_ligands_sdf/1gwx_433.sdf
    3570 2020-05-08 17:41 test/pdb_ligands_sdf/2wtj_wtj.sdf
    4741 2020-05-08 17:41 test/pdb_ligands_sdf/1o1s_1nh.sdf
    3359 2020-05-08 17:41 test/pdb_ligands_sdf/1ev9_gts.sdf
    4468 2020-05-08 17:41 test/pdb_ligands_sdf/5cgj_51m.sdf
    4936 2020-05-08 17:41 test/pdb_ligands_sdf/5j63_g3n.sdf
    5058 2020-05-08 17:41 test/pdb_ligands_sdf/4al4_w7e.sdf
    3933 2020-05-08 17:41 test/pdb_ligands_sdf/3lfn_a27.sdf
    3457 2020-05-08 17:41 test/pdb_ligands_sdf/5ehp_5oa.sdf
    2893 2020-05-08 17:41 test/pdb_ligands_sdf/4zvz_4tf.sdf
    3007 2020-05-08 17:41 test/pdb_ligands_sdf/1xl8_ocb.sdf
    5221 2020-05-08 17:41 test/pdb_ligands_sdf/5m6n_7h9.sdf
    2441 2020-05-08 17:41 test/pdb_ligands_sdf/4zx2_4te.sdf
    3078 2020-05-08 17:41 test/pdb_ligands_sdf/3hl8_bbp.sdf
    4638 2020-05-08 17:41 test/pdb_ligands_sdf/1rd4_l08.sdf
    4472 2020-05-08 17:41 test/pdb_ligands_sdf/3hnb_768.sdf
    4110 2020-05-08 17:41 test/pdb_ligands_sdf/5jun_6nu.sdf
    7326 2020-05-08 17:41 test/pdb_ligands_sdf/2h9i_ead.sdf
    3968 2020-05-08 17:41 test/pdb_ligands_sdf/1c8l_bin.sdf
    3291 2020-05-08 17:41 test/pdb_ligands_sdf/1zr8_ajm.sdf
    3648 2020-05-08 17:41 test/pdb_ligands_sdf/3pyy_3yy.sdf
    1981 2020-05-08 17:41 test/pdb_ligands_sdf/3mag_3ma.sdf
    5890 2020-05-08 17:41 test/pdb_ligands_sdf/1ivq_0px.sdf
    2743 2020-05-08 17:41 test/pdb_ligands_sdf/5p9z_7jq.sdf
    4811 2020-05-08 17:41 test/pdb_ligands_sdf/3dzq_ifc.sdf
    5584 2020-05-08 17:41 test/pdb_ligands_sdf/3zlr_x0b.sdf
    3167 2020-05-08 17:41 test/pdb_ligands_sdf/2zox_png.sdf
    2963 2020-05-08 17:41 test/pdb_ligands_sdf/4qf9_35k.sdf
    3814 2020-05-08 17:41 test/pdb_ligands_sdf/5hnb_62m.sdf
    3730 2020-05-08 17:41 test/pdb_ligands_sdf/4eh9_0oq.sdf
    4042 2020-05-08 17:41 test/pdb_ligands_sdf/3hxy_5al.sdf
    3518 2020-05-08 17:41 test/pdb_ligands_sdf/5t5t_75o.sdf
    5181 2020-05-08 17:41 test/pdb_ligands_sdf/4mkc_4mk.sdf
    2673 2020-05-08 17:41 test/pdb_ligands_sdf/3rps_4b0.sdf
    5431 2020-05-08 17:41 test/pdb_ligands_sdf/1dmp_dmq.sdf
    4315 2020-05-08 17:41 test/pdb_ligands_sdf/4lsj_lsj.sdf
    2574 2020-05-08 17:41 test/pdb_ligands_sdf/2noa_3tc.sdf
    6795 2020-05-08 17:41 test/pdb_ligands_sdf/5qcn_bvm.sdf
    2528 2020-05-08 17:41 test/pdb_ligands_sdf/2ki5_ac2.sdf
    1929 2020-05-08 17:41 test/pdb_ligands_sdf/5fve_2ho.sdf
    2896 2020-05-08 17:41 test/pdb_ligands_sdf/4b0i_kbp.sdf
    2313 2020-05-08 17:41 test/pdb_ligands_sdf/3njy_8xq.sdf
    3435 2020-05-08 17:41 test/pdb_ligands_sdf/3fxw_f10.sdf
    3092 2020-05-08 17:41 test/pdb_ligands_sdf/4pp0_op1.sdf
    4729 2020-05-08 17:41 test/pdb_ligands_sdf/4ppb_2vv.sdf
    2326 2020-05-08 17:41 test/pdb_ligands_sdf/1u30_gox.sdf
    1726 2020-05-08 17:41 test/pdb_ligands_sdf/5lx5_dpo.sdf
    3070 2020-05-08 17:41 test/pdb_ligands_sdf/4wdu_wdu.sdf
    6293 2020-05-08 17:41 test/pdb_ligands_sdf/3vqs_jt1.sdf
    4722 2020-05-08 17:41 test/pdb_ligands_sdf/1jf2_czh.sdf
    2418 2020-05-08 17:41 test/pdb_ligands_sdf/3f1a_hs7.sdf
    3231 2020-05-08 17:41 test/pdb_ligands_sdf/1fm6_9cr.sdf
    4372 2020-05-08 17:41 test/pdb_ligands_sdf/3i0a_2ds.sdf
    6155 2020-05-08 17:41 test/pdb_ligands_sdf/1nuq_nxx.sdf
    3766 2020-05-08 17:41 test/pdb_ligands_sdf/1xpz_4tz.sdf
    3245 2020-05-08 17:41 test/pdb_ligands_sdf/1q22_and.sdf
    4964 2020-05-08 17:41 test/pdb_ligands_sdf/2e9n_76a.sdf
    3461 2020-05-08 17:41 test/pdb_ligands_sdf/4d30_eg8.sdf
    2812 2020-05-08 17:41 test/pdb_ligands_sdf/4qmc_bso.sdf
    1795 2020-05-08 17:41 test/pdb_ligands_sdf/1o7g_npy.sdf
    3473 2020-05-08 17:41 test/pdb_ligands_sdf/3v3v_myu.sdf
    3990 2020-05-08 17:41 test/pdb_ligands_sdf/1sv5_65b.sdf
    3529 2020-05-08 17:41 test/pdb_ligands_sdf/5a5i_xi1.sdf
    5272 2020-05-08 17:41 test/pdb_ligands_sdf/4ngq_j37.sdf
    4965 2020-05-08 17:41 test/pdb_ligands_sdf/1aqx_gtd.sdf
    4124 2020-05-08 17:41 test/pdb_ligands_sdf/5tb9_1ry.sdf
    3526 2020-05-08 17:41 test/pdb_ligands_sdf/4mye_xmm.sdf
    3233 2020-05-08 17:41 test/pdb_ligands_sdf/2fyv_w72.sdf
    3364 2020-05-08 17:41 test/pdb_ligands_sdf/5vvn_p94.sdf
    4739 2020-05-08 17:41 test/pdb_ligands_sdf/2qct_561.sdf
    4433 2020-05-08 17:41 test/pdb_ligands_sdf/4nr5_2ll.sdf
    3793 2020-05-08 17:41 test/pdb_ligands_sdf/5dke_5c8.sdf
    4477 2020-05-08 17:41 test/pdb_ligands_sdf/2fmn_4hf.sdf
    2067 2020-05-08 17:41 test/pdb_ligands_sdf/4tuv_cpz.sdf
    2892 2020-05-08 17:41 test/pdb_ligands_sdf/4mkt_1v6.sdf
    3732 2020-05-08 17:41 test/pdb_ligands_sdf/3wzo_zoe.sdf
    2899 2020-05-08 17:41 test/pdb_ligands_sdf/5l4u_6ks.sdf
    3733 2020-05-08 17:41 test/pdb_ligands_sdf/4m14_qws.sdf
    3117 2020-05-08 17:41 test/pdb_ligands_sdf/2ga2_a19.sdf
    4044 2020-05-08 17:41 test/pdb_ligands_sdf/1nfw_rrr.sdf
    3370 2020-05-08 17:41 test/pdb_ligands_sdf/5vkn_q6f.sdf
    3604 2020-05-08 17:41 test/pdb_ligands_sdf/4or7_25u.sdf
    7515 2020-05-08 17:41 test/pdb_ligands_sdf/1dao_fab.sdf
    4242 2020-05-08 17:41 test/pdb_ligands_sdf/5ueq_87m.sdf
    4799 2020-05-08 17:41 test/pdb_ligands_sdf/5nk9_912.sdf
    3473 2020-05-08 17:41 test/pdb_ligands_sdf/4qwa_0g8.sdf
    3656 2020-05-08 17:41 test/pdb_ligands_sdf/5aep_qup.sdf
    4581 2020-05-08 17:41 test/pdb_ligands_sdf/4v24_gyr.sdf
    4262 2020-05-08 17:41 test/pdb_ligands_sdf/4q1e_2y7.sdf
    6472 2020-05-08 17:41 test/pdb_ligands_sdf/5ohj_9ve.sdf
    4297 2020-05-08 17:41 test/pdb_ligands_sdf/2ynh_eur.sdf
    5917 2020-05-08 17:41 test/pdb_ligands_sdf/5q0g_9f7.sdf
    1761 2020-05-08 17:41 test/pdb_ligands_sdf/1c3q_tze.sdf
    3773 2020-05-08 17:41 test/pdb_ligands_sdf/5n84_8q5.sdf
    3274 2020-05-08 17:41 test/pdb_ligands_sdf/3qgw_l7a.sdf
    2564 2020-05-08 17:41 test/pdb_ligands_sdf/3c6p_2s3.sdf
    3434 2020-05-08 17:41 test/pdb_ligands_sdf/5jgo_6jx.sdf
    4565 2020-05-08 17:41 test/pdb_ligands_sdf/4zgk_4nx.sdf
    4858 2020-05-08 17:41 test/pdb_ligands_sdf/4wxi_3vm.sdf
    2317 2020-05-08 17:41 test/pdb_ligands_sdf/4gd4_0ws.sdf
    4728 2020-05-08 17:41 test/pdb_ligands_sdf/3vt6_5yi.sdf
    4449 2020-05-08 17:41 test/pdb_ligands_sdf/4o13_2p1.sdf
    3476 2020-05-08 17:41 test/pdb_ligands_sdf/3cf6_sp1.sdf
    2342 2020-05-08 17:41 test/pdb_ligands_sdf/5gi8_7dp.sdf
    4802 2020-05-08 17:41 test/pdb_ligands_sdf/1tmn_0zn.sdf
    5659 2020-05-08 17:41 test/pdb_ligands_sdf/5iug_729.sdf
    3151 2020-05-08 17:41 test/pdb_ligands_sdf/1g4p_fqp.sdf
    3214 2020-05-08 17:41 test/pdb_ligands_sdf/5amn_dtq.sdf
    4450 2020-05-08 17:41 test/pdb_ligands_sdf/5c83_4yn.sdf
    2812 2020-05-08 17:41 test/pdb_ligands_sdf/3wik_lct.sdf
    3652 2020-05-08 17:41 test/pdb_ligands_sdf/4wev_suz.sdf
    1976 2020-05-08 17:41 test/pdb_ligands_sdf/3au9_fom.sdf
    4530 2020-05-08 17:41 test/pdb_ligands_sdf/3ny4_smx.sdf
    2921 2020-05-08 17:41 test/pdb_ligands_sdf/5x1v_7xx.sdf
    3530 2020-05-08 17:41 test/pdb_ligands_sdf/3l0k_6au.sdf
    4199 2020-05-08 17:41 test/pdb_ligands_sdf/4hxw_1a0.sdf
    4661 2020-05-08 17:41 test/pdb_ligands_sdf/3pvw_qrx.sdf
    2187 2020-05-08 17:41 test/pdb_ligands_sdf/5ale_onr.sdf
    3913 2020-05-08 17:41 test/pdb_ligands_sdf/1s3v_tqd.sdf
    3543 2020-05-08 17:41 test/pdb_ligands_sdf/3g0g_rum.sdf
    3382 2020-05-08 17:41 test/pdb_ligands_sdf/5cy9_e0a.sdf
    6544 2020-05-08 17:41 test/pdb_ligands_sdf/3vi7_cbd.sdf
    4209 2020-05-08 17:41 test/pdb_ligands_sdf/4ug9_1ew.sdf
    2979 2020-05-08 17:41 test/pdb_ligands_sdf/5mih_7nu.sdf
    4008 2020-05-08 17:41 test/pdb_ligands_sdf/4hgl_0yo.sdf
    5571 2020-05-08 17:41 test/pdb_ligands_sdf/3o9f_k2d.sdf
    3398 2020-05-08 17:41 test/pdb_ligands_sdf/5k75_6qx.sdf
    5010 2020-05-08 17:41 test/pdb_ligands_sdf/3hc6_088.sdf
    5249 2020-05-08 17:41 test/pdb_ligands_sdf/3p6t_sbf.sdf
    2124 2020-05-08 17:41 test/pdb_ligands_sdf/3rwb_4pl.sdf
    4276 2020-05-08 17:41 test/pdb_ligands_sdf/4awi_aq2.sdf
    4574 2020-05-08 17:41 test/pdb_ligands_sdf/1wqv_psm.sdf
    3276 2020-05-08 17:41 test/pdb_ligands_sdf/5g6q_tue.sdf
    3386 2020-05-08 17:41 test/pdb_ligands_sdf/2gj4_2th.sdf
    3660 2020-05-08 17:41 test/pdb_ligands_sdf/5i88_69g.sdf
    3126 2020-05-08 17:41 test/pdb_ligands_sdf/3v35_nti.sdf
    7332 2020-05-08 17:41 test/pdb_ligands_sdf/1skx_rfp.sdf
    4439 2020-05-08 17:41 test/pdb_ligands_sdf/1hna_gdn.sdf
    2456 2020-05-08 17:41 test/pdb_ligands_sdf/2rfh_23n.sdf
    3848 2020-05-08 17:41 test/pdb_ligands_sdf/2p93_me1.sdf
    1974 2020-05-08 17:41 test/pdb_ligands_sdf/1hyo_hbu.sdf
    1932 2020-05-08 17:41 test/pdb_ligands_sdf/3pci_ihb.sdf
    4758 2020-05-08 17:41 test/pdb_ligands_sdf/5lsg_qzq.sdf
    4743 2020-05-08 17:41 test/pdb_ligands_sdf/5kpp_6wz.sdf
    4446 2020-05-08 17:41 test/pdb_ligands_sdf/4dvi_2iw.sdf
    4633 2020-05-08 17:41 test/pdb_ligands_sdf/5a8x_iuy.sdf
    3270 2020-05-08 17:41 test/pdb_ligands_sdf/4mlh_vo2.sdf
    3781 2020-05-08 17:41 test/pdb_ligands_sdf/3g5e_q74.sdf
    3068 2020-05-08 17:41 test/pdb_ligands_sdf/3wqs_kbk.sdf
    4984 2020-05-08 17:41 test/pdb_ligands_sdf/2ghg_a53.sdf
    3180 2020-05-08 17:41 test/pdb_ligands_sdf/4ek9_ep4.sdf
    1981 2020-05-08 17:41 test/pdb_ligands_sdf/4jmt_1lz.sdf
    2377 2020-05-08 17:41 test/pdb_ligands_sdf/4kgj_idf.sdf
    4957 2020-05-08 17:41 test/pdb_ligands_sdf/1jin_ktn.sdf
    4135 2020-05-08 17:41 test/pdb_ligands_sdf/5i3r_idk.sdf
    5650 2020-05-08 17:41 test/pdb_ligands_sdf/4as9_4qs.sdf
    3305 2020-05-08 17:41 test/pdb_ligands_sdf/3w1x_xro.sdf
    4487 2020-05-08 17:41 test/pdb_ligands_sdf/3ho9_n3a.sdf
    3333 2020-05-08 17:41 test/pdb_ligands_sdf/5kmo_6um.sdf
    5804 2020-05-08 17:41 test/pdb_ligands_sdf/4q4d_2yn.sdf
    2369 2020-05-08 17:41 test/pdb_ligands_sdf/2x0u_x0u.sdf
    1948 2020-05-08 17:41 test/pdb_ligands_sdf/1a96_xan.sdf
    4043 2020-05-08 17:41 test/pdb_ligands_sdf/3vbq_0f5.sdf
    3168 2020-05-08 17:41 test/pdb_ligands_sdf/5k0e_6oz.sdf
    4011 2020-05-08 17:41 test/pdb_ligands_sdf/2gtm_lid.sdf
    3037 2020-05-08 17:41 test/pdb_ligands_sdf/5c1q_4yk.sdf
    5968 2020-05-08 17:41 test/pdb_ligands_sdf/3ajh_bl3.sdf
    3920 2020-05-08 17:41 test/pdb_ligands_sdf/3ddu_552.sdf
    5375 2020-05-08 17:41 test/pdb_ligands_sdf/3vtb_tka.sdf
    4117 2020-05-08 17:41 test/pdb_ligands_sdf/4k4g_1s0.sdf
    4412 2020-05-08 17:41 test/pdb_ligands_sdf/4zz3_4dw.sdf
    4463 2020-05-08 17:41 test/pdb_ligands_sdf/4oho_2tg.sdf
    3691 2020-05-08 17:41 test/pdb_ligands_sdf/1o2p_972.sdf
    4385 2020-05-08 17:41 test/pdb_ligands_sdf/2b55_d31.sdf
    2057 2020-05-08 17:41 test/pdb_ligands_sdf/5u0w_9mg.sdf
    2438 2020-05-08 17:41 test/pdb_ligands_sdf/1zh6_4af.sdf
    4210 2020-05-08 17:41 test/pdb_ligands_sdf/4xly_ecp.sdf
    4120 2020-05-08 17:41 test/pdb_ligands_sdf/2g2h_p16.sdf
    4247 2020-05-08 17:41 test/pdb_ligands_sdf/5nhf_8x5.sdf
    2306 2020-05-08 17:41 test/pdb_ligands_sdf/4ef6_i2e.sdf
    4876 2020-05-08 17:41 test/pdb_ligands_sdf/4za7_fzz.sdf
    4296 2020-05-08 17:41 test/pdb_ligands_sdf/3l7k_c2g.sdf
    4348 2020-05-08 17:41 test/pdb_ligands_sdf/5c9c_4z5.sdf
    3364 2020-05-08 17:41 test/pdb_ligands_sdf/4xud_43h.sdf
    3414 2020-05-08 17:41 test/pdb_ligands_sdf/5ni6_dj3.sdf
    3746 2020-05-08 17:41 test/pdb_ligands_sdf/4m4q_21a.sdf
    2523 2020-05-08 17:41 test/pdb_ligands_sdf/1djw_cip.sdf
    1370 2020-05-08 17:41 test/pdb_ligands_sdf/4x2p_3py.sdf
    3145 2020-05-08 17:41 test/pdb_ligands_sdf/2xn5_fun.sdf
    3633 2020-05-08 17:41 test/pdb_ligands_sdf/1n5j_tyd.sdf
    1692 2020-05-08 17:41 test/pdb_ligands_sdf/1l4m_2ac.sdf
    2999 2020-05-08 17:41 test/pdb_ligands_sdf/1qw9_khp.sdf
    3748 2020-05-08 17:41 test/pdb_ligands_sdf/4djw_0kp.sdf
    5569 2020-05-08 17:41 test/pdb_ligands_sdf/5ln2_6zt.sdf
    4270 2020-05-08 17:41 test/pdb_ligands_sdf/4clb_83t.sdf
    1926 2020-05-08 17:41 test/pdb_ligands_sdf/5cic_51r.sdf
    5001 2020-05-08 17:41 test/pdb_ligands_sdf/4gb2_0lq.sdf
    3516 2020-05-08 17:41 test/pdb_ligands_sdf/4xm6_41r.sdf
    4364 2020-05-08 17:41 test/pdb_ligands_sdf/2jkh_bi7.sdf
    4848 2020-05-08 17:41 test/pdb_ligands_sdf/1c3e_nhr.sdf
    3750 2020-05-08 17:41 test/pdb_ligands_sdf/3zo4_qwi.sdf
    3103 2020-05-08 17:41 test/pdb_ligands_sdf/4eix_nim.sdf
    3437 2020-05-08 17:41 test/pdb_ligands_sdf/2w75_n8e.sdf
    4554 2020-05-08 17:41 test/pdb_ligands_sdf/5p90_769.sdf
    2012 2020-05-08 17:41 test/pdb_ligands_sdf/3hfx_152.sdf
    4426 2020-05-08 17:41 test/pdb_ligands_sdf/3l2u_elv.sdf
    3050 2020-05-08 17:41 test/pdb_ligands_sdf/1u1e_182.sdf
    4607 2020-05-08 17:41 test/pdb_ligands_sdf/2r9o_y15.sdf
    2576 2020-05-08 17:41 test/pdb_ligands_sdf/4yqg_4gy.sdf
    3178 2020-05-08 17:41 test/pdb_ligands_sdf/2gyw_obi.sdf
    4282 2020-05-08 17:41 test/pdb_ligands_sdf/5hdv_60v.sdf
    4196 2020-05-08 17:41 test/pdb_ligands_sdf/5mmo_9jg.sdf
    6582 2020-05-08 17:41 test/pdb_ligands_sdf/5qcd_bhj.sdf
    4629 2020-05-08 17:41 test/pdb_ligands_sdf/5ixy_gn2.sdf
    3005 2020-05-08 17:41 test/pdb_ligands_sdf/3p3u_3m4.sdf
    3894 2020-05-08 17:41 test/pdb_ligands_sdf/3s7l_591.sdf
    2192 2020-05-08 17:41 test/pdb_ligands_sdf/4kib_56d.sdf
    3271 2020-05-08 17:41 test/pdb_ligands_sdf/1p6l_dp1.sdf
    2547 2020-05-08 17:41 test/pdb_ligands_sdf/3w4j_2ld.sdf
    3275 2020-05-08 17:41 test/pdb_ligands_sdf/4chy_c5q.sdf
    4234 2020-05-08 17:41 test/pdb_ligands_sdf/2ezt_tdm.sdf
    2806 2020-05-08 17:41 test/pdb_ligands_sdf/4y4x_47q.sdf
    5576 2020-05-08 17:41 test/pdb_ligands_sdf/4xb5_45d.sdf
    3850 2020-05-08 17:41 test/pdb_ligands_sdf/2chx_090.sdf
    3519 2020-05-08 17:41 test/pdb_ligands_sdf/4nr4_2lk.sdf
    4589 2020-05-08 17:41 test/pdb_ligands_sdf/2qt9_524.sdf
    3487 2020-05-08 17:41 test/pdb_ligands_sdf/4bue_jqf.sdf
    3632 2020-05-08 17:41 test/pdb_ligands_sdf/3lam_krp.sdf
    5200 2020-05-08 17:41 test/pdb_ligands_sdf/2q6b_hr2.sdf
    2439 2020-05-08 17:41 test/pdb_ligands_sdf/5v19_8v4.sdf
    4977 2020-05-08 17:41 test/pdb_ligands_sdf/3o8h_o8h.sdf
    2884 2020-05-08 17:41 test/pdb_ligands_sdf/3pmy_41l.sdf
    3887 2020-05-08 17:41 test/pdb_ligands_sdf/5crz_eb7.sdf
    3876 2020-05-08 17:41 test/pdb_ligands_sdf/4kp0_kpk.sdf
    6222 2020-05-08 17:41 test/pdb_ligands_sdf/2grx_fci.sdf
    4211 2020-05-08 17:41 test/pdb_ligands_sdf/4jyi_jyi.sdf
    3914 2020-05-08 17:41 test/pdb_ligands_sdf/1ya4_ctx.sdf
    1941 2020-05-08 17:41 test/pdb_ligands_sdf/5g65_2aq.sdf
    1833 2020-05-08 17:41 test/pdb_ligands_sdf/3scz_hpa.sdf
    4424 2020-05-08 17:41 test/pdb_ligands_sdf/4w4y_3hq.sdf
    3747 2020-05-08 17:41 test/pdb_ligands_sdf/5ccs_c4y.sdf
    1677 2020-05-08 17:41 test/pdb_ligands_sdf/4kkz_1rf.sdf
    3814 2020-05-08 17:41 test/pdb_ligands_sdf/5dsg_0hk.sdf
    4397 2020-05-08 17:41 test/pdb_ligands_sdf/1glj_ats.sdf
    1972 2020-05-08 17:41 test/pdb_ligands_sdf/5mrh_q9z.sdf
    2343 2020-05-08 17:41 test/pdb_ligands_sdf/5a3x_qiv.sdf
    2455 2020-05-08 17:41 test/pdb_ligands_sdf/4do4_djn.sdf
    3563 2020-05-08 17:41 test/pdb_ligands_sdf/4k7q_zld.sdf
    2061 2020-05-08 17:41 test/pdb_ligands_sdf/5ifd_6aq.sdf
    3885 2020-05-08 17:41 test/pdb_ligands_sdf/2qzr_s79.sdf
    1935 2020-05-08 17:41 test/pdb_ligands_sdf/5aqp_1lq.sdf
    4487 2020-05-08 17:41 test/pdb_ligands_sdf/3mvm_39p.sdf
    1393 2020-05-08 17:41 test/pdb_ligands_sdf/2xqj_vx.sdf
    4352 2020-05-08 17:41 test/pdb_ligands_sdf/4wq6_3tq.sdf
    3847 2020-05-08 17:41 test/pdb_ligands_sdf/1ybh_cie.sdf
    3583 2020-05-08 17:41 test/pdb_ligands_sdf/1bnt_al2.sdf
    2441 2020-05-08 17:41 test/pdb_ligands_sdf/4y15_482.sdf
    3681 2020-05-08 17:41 test/pdb_ligands_sdf/4a51_dq8.sdf
    4954 2020-05-08 17:41 test/pdb_ligands_sdf/4b1j_a1r.sdf
    3066 2020-05-08 17:41 test/pdb_ligands_sdf/2wm3_nfl.sdf
    3367 2020-05-08 17:41 test/pdb_ligands_sdf/3di6_pdz.sdf
    3872 2020-05-08 17:41 test/pdb_ligands_sdf/5n3v_8l5.sdf
    4102 2020-05-08 17:41 test/pdb_ligands_sdf/5t2t_0n8.sdf
    2490 2020-05-08 17:41 test/pdb_ligands_sdf/2ceq_gim.sdf
    5621 2020-05-08 17:41 test/pdb_ligands_sdf/4ib4_erm.sdf
    1944 2020-05-08 17:41 test/pdb_ligands_sdf/4ypz_4fl.sdf
    4877 2020-05-08 17:41 test/pdb_ligands_sdf/3h9f_92m.sdf
    3458 2020-05-08 17:41 test/pdb_ligands_sdf/3ilz_b72.sdf
    4350 2020-05-08 17:41 test/pdb_ligands_sdf/4cqn_ila.sdf
    3627 2020-05-08 17:41 test/pdb_ligands_sdf/4u2z_fmo.sdf
    2715 2020-05-08 17:41 test/pdb_ligands_sdf/3ao5_bby.sdf
    3676 2020-05-08 17:41 test/pdb_ligands_sdf/4ze0_vor.sdf
    6775 2020-05-08 17:41 test/pdb_ligands_sdf/2xyd_3es.sdf
    4138 2020-05-08 17:41 test/pdb_ligands_sdf/5kz8_6z5.sdf
    3307 2020-05-08 17:41 test/pdb_ligands_sdf/5dw0_pls.sdf
    2927 2020-05-08 17:41 test/pdb_ligands_sdf/3vgc_srb.sdf
    2270 2020-05-08 17:41 test/pdb_ligands_sdf/3w1p_ero.sdf
    5472 2020-05-08 17:41 test/pdb_ligands_sdf/3hvi_619.sdf
    3870 2020-05-08 17:41 test/pdb_ligands_sdf/4rka_3ry.sdf
    3531 2020-05-08 17:41 test/pdb_ligands_sdf/1sto_omp.sdf
    3854 2020-05-08 17:41 test/pdb_ligands_sdf/5i89_69b.sdf
    4765 2020-05-08 17:41 test/pdb_ligands_sdf/5xhc_87u.sdf
    1860 2020-05-08 17:41 test/pdb_ligands_sdf/5iu6_7hx.sdf
    4539 2020-05-08 17:41 test/pdb_ligands_sdf/3hok_q80.sdf
    4888 2020-05-08 17:41 test/pdb_ligands_sdf/5enq_5qe.sdf
    3014 2020-05-08 17:41 test/pdb_ligands_sdf/4la6_la6.sdf
    4010 2020-05-08 17:41 test/pdb_ligands_sdf/5m9w_7gr.sdf
    5300 2020-05-08 17:41 test/pdb_ligands_sdf/2b7d_c1b.sdf
    5269 2020-05-08 17:41 test/pdb_ligands_sdf/4tyj_0li.sdf
    4025 2020-05-08 17:41 test/pdb_ligands_sdf/4cws_g3r.sdf
    2910 2020-05-08 17:41 test/pdb_ligands_sdf/4x2f_3wj.sdf
    3696 2020-05-08 17:41 test/pdb_ligands_sdf/1onz_968.sdf
    3097 2020-05-08 17:41 test/pdb_ligands_sdf/3my1_rfz.sdf
    2897 2020-05-08 17:41 test/pdb_ligands_sdf/3pm4_f5n.sdf
    2195 2020-05-08 17:41 test/pdb_ligands_sdf/2d0e_nq.sdf
    5095 2020-05-08 17:41 test/pdb_ligands_sdf/4a5s_n7f.sdf
    5630 2020-05-08 17:41 test/pdb_ligands_sdf/5tqf_7kr.sdf
    7431 2020-05-08 17:41 test/pdb_ligands_sdf/3qak_uka.sdf
    3991 2020-05-08 17:41 test/pdb_ligands_sdf/4qfc_31t.sdf
    1823 2020-05-08 17:41 test/pdb_ligands_sdf/5dtj_5g8.sdf
    4566 2020-05-08 17:41 test/pdb_ligands_sdf/1uhh_czp.sdf
    3162 2020-05-08 17:41 test/pdb_ligands_sdf/4ydm_4aj.sdf
    4087 2020-05-08 17:41 test/pdb_ligands_sdf/3czr_3cz.sdf
    4242 2020-05-08 17:41 test/pdb_ligands_sdf/5dk9_5cc.sdf
    2540 2020-05-08 17:41 test/pdb_ligands_sdf/1mc1_pcx.sdf
    5375 2020-05-08 17:41 test/pdb_ligands_sdf/6bdk_dj1.sdf
    4564 2020-05-08 17:41 test/pdb_ligands_sdf/4upj_u04.sdf
    5229 2020-05-08 17:41 test/pdb_ligands_sdf/4ceq_qch.sdf
    4388 2020-05-08 17:41 test/pdb_ligands_sdf/3tvc_e3p.sdf
    5323 2020-05-08 17:41 test/pdb_ligands_sdf/4cpe_luv.sdf
    2359 2020-05-08 17:41 test/pdb_ligands_sdf/1x2b_stx.sdf
    4603 2020-05-08 17:41 test/pdb_ligands_sdf/2glm_scb.sdf
    3222 2020-05-08 17:41 test/pdb_ligands_sdf/3v7w_zas.sdf
    3154 2020-05-08 17:41 test/pdb_ligands_sdf/5ezh_841.sdf
    3221 2020-05-08 17:41 test/pdb_ligands_sdf/3gs0_6bd.sdf
    2090 2020-05-08 17:41 test/pdb_ligands_sdf/4h81_wj2.sdf
    3388 2020-05-08 17:41 test/pdb_ligands_sdf/5fvy_w64.sdf
    4478 2020-05-08 17:41 test/pdb_ligands_sdf/2j4z_626.sdf
    2113 2020-05-08 17:41 test/pdb_ligands_sdf/2z9v_pxm.sdf
    3239 2020-05-08 17:41 test/pdb_ligands_sdf/5ll5_6yh.sdf
    4240 2020-05-08 17:41 test/pdb_ligands_sdf/2om9_aja.sdf
    5231 2020-05-08 17:41 test/pdb_ligands_sdf/3u6h_03x.sdf
    5165 2020-05-08 17:41 test/pdb_ligands_sdf/3kfj_yen.sdf
    5934 2020-05-08 17:41 test/pdb_ligands_sdf/4gts_7tp.sdf
    1391 2020-05-08 17:41 test/pdb_ligands_sdf/4oxn_2nv.sdf
    4744 2020-05-08 17:41 test/pdb_ligands_sdf/5dug_5fv.sdf
    2153 2020-05-08 17:41 test/pdb_ligands_sdf/3c4h_drl.sdf
    2925 2020-05-08 17:41 test/pdb_ligands_sdf/4yj2_4ed.sdf
    2431 2020-05-08 17:41 test/pdb_ligands_sdf/1rsi_977.sdf
    5342 2020-05-08 17:41 test/pdb_ligands_sdf/4jmu_1ml.sdf
    4877 2020-05-08 17:41 test/pdb_ligands_sdf/1ppk_ivv.sdf
    2242 2020-05-08 17:41 test/pdb_ligands_sdf/2opa_fhc.sdf
    2988 2020-05-08 17:41 test/pdb_ligands_sdf/4kb8_1qo.sdf
    5855 2020-05-08 17:41 test/pdb_ligands_sdf/4o16_1xc.sdf
    7154 2020-05-08 17:41 test/pdb_ligands_sdf/1q7g_nho.sdf
    3652 2020-05-08 17:41 test/pdb_ligands_sdf/5jvd_6nl.sdf
    4276 2020-05-08 17:41 test/pdb_ligands_sdf/4d9t_0jg.sdf
    3234 2020-05-08 17:41 test/pdb_ligands_sdf/5ccr_4zt.sdf
    4697 2020-05-08 17:41 test/pdb_ligands_sdf/5ece_5n2.sdf
    2223 2020-05-08 17:41 test/pdb_ligands_sdf/1p0e_prf.sdf
    3429 2020-05-08 17:41 test/pdb_ligands_sdf/3f2n_izz.sdf
    4185 2020-05-08 17:41 test/pdb_ligands_sdf/2of4_979.sdf
    4072 2020-05-08 17:41 test/pdb_ligands_sdf/3w0g_w07.sdf
    2788 2020-05-08 17:41 test/pdb_ligands_sdf/1zoh_k44.sdf
    2304 2020-05-08 17:41 test/pdb_ligands_sdf/2zp1_iyr.sdf
    3485 2020-05-08 17:41 test/pdb_ligands_sdf/3lxk_mi1.sdf
    3630 2020-05-08 17:41 test/pdb_ligands_sdf/4hw3_19g.sdf
    3346 2020-05-08 17:41 test/pdb_ligands_sdf/4qyf_3dv.sdf
    4398 2020-05-08 17:41 test/pdb_ligands_sdf/3thb_3ta.sdf
    3105 2020-05-08 17:41 test/pdb_ligands_sdf/4bnu_9kq.sdf
    1991 2020-05-08 17:41 test/pdb_ligands_sdf/3n8k_d1x.sdf
    5042 2020-05-08 17:41 test/pdb_ligands_sdf/2pe2_464.sdf
    2416 2020-05-08 17:41 test/pdb_ligands_sdf/2ef6_mdm.sdf
    3976 2020-05-08 17:41 test/pdb_ligands_sdf/4yq3_4g1.sdf
    2883 2020-05-08 17:41 test/pdb_ligands_sdf/4l0s_1uz.sdf
    9176 2020-05-08 17:41 test/pdb_ligands_sdf/3t8x_t8x.sdf
    5146 2020-05-08 17:41 test/pdb_ligands_sdf/2flm_6ca.sdf
    4445 2020-05-08 17:41 test/pdb_ligands_sdf/4mkb_28v.sdf
    3548 2020-05-08 17:41 test/pdb_ligands_sdf/2vo0_m03.sdf
    2623 2020-05-08 17:41 test/pdb_ligands_sdf/1aer_tia.sdf
    2041 2020-05-08 17:41 test/pdb_ligands_sdf/3dx4_goo.sdf
    1761 2020-05-08 17:41 test/pdb_ligands_sdf/1t26_gbd.sdf
    6306 2020-05-08 17:41 test/pdb_ligands_sdf/1gar_u89.sdf
    6217 2020-05-08 17:41 test/pdb_ligands_sdf/3b03_vnr.sdf
    1809 2020-05-08 17:41 test/pdb_ligands_sdf/1iut_pab.sdf
    2196 2020-05-08 17:41 test/pdb_ligands_sdf/2oxy_k17.sdf
    3691 2020-05-08 17:41 test/pdb_ligands_sdf/3sp5_cx7.sdf
    2712 2020-05-08 17:41 test/pdb_ligands_sdf/4n9q_uq1.sdf
    4136 2020-05-08 17:41 test/pdb_ligands_sdf/2ojf_4py.sdf
    2572 2020-05-08 17:41 test/pdb_ligands_sdf/5f39_5ub.sdf
    3496 2020-05-08 17:41 test/pdb_ligands_sdf/4z3v_4l6.sdf
    4199 2020-05-08 17:41 test/pdb_ligands_sdf/1zht_hcr.sdf
    3756 2020-05-08 17:41 test/pdb_ligands_sdf/4la7_a1o.sdf
    3645 2020-05-08 17:41 test/pdb_ligands_sdf/4dch_4dc.sdf
    2973 2020-05-08 17:41 test/pdb_ligands_sdf/1jdz_fmb.sdf
    5218 2020-05-08 17:41 test/pdb_ligands_sdf/3be2_raj.sdf
    2626 2020-05-08 17:41 test/pdb_ligands_sdf/2y04_68h.sdf
    5937 2020-05-08 17:41 test/pdb_ligands_sdf/3gnw_xnc.sdf
    2830 2020-05-08 17:41 test/pdb_ligands_sdf/1c86_opa.sdf
    3004 2020-05-08 17:41 test/pdb_ligands_sdf/3cf9_agi.sdf
    3797 2020-05-08 17:41 test/pdb_ligands_sdf/3pa4_c72.sdf
    4339 2020-05-08 17:41 test/pdb_ligands_sdf/5iso_992.sdf
    2935 2020-05-08 17:41 test/pdb_ligands_sdf/4d5h_9rm.sdf
    2426 2020-05-08 17:41 test/pdb_ligands_sdf/4yil_4d3.sdf
    2240 2020-05-08 17:41 test/pdb_ligands_sdf/1o5b_esi.sdf
    3882 2020-05-08 17:41 test/pdb_ligands_sdf/5f4n_5uy.sdf
    4159 2020-05-08 17:41 test/pdb_ligands_sdf/6bd5_d7m.sdf
    2375 2020-05-08 17:41 test/pdb_ligands_sdf/1bzm_mzm.sdf
    2087 2020-05-08 17:41 test/pdb_ligands_sdf/4p58_2f6.sdf
    4819 2020-05-08 17:41 test/pdb_ligands_sdf/4eph_0rk.sdf
    1938 2020-05-08 17:41 test/pdb_ligands_sdf/2vsu_v55.sdf
    4053 2020-05-08 17:41 test/pdb_ligands_sdf/4xir_40x.sdf
    2756 2020-05-08 17:41 test/pdb_ligands_sdf/1rxo_rub.sdf
    4040 2020-05-08 17:41 test/pdb_ligands_sdf/4fl6_uwn.sdf
    4287 2020-05-08 17:41 test/pdb_ligands_sdf/5jt9_7af.sdf
    1982 2020-05-08 17:41 test/pdb_ligands_sdf/4xoy_dx4.sdf
    3448 2020-05-08 17:41 test/pdb_ligands_sdf/3ozj_bgv.sdf
    4852 2020-05-08 17:41 test/pdb_ligands_sdf/1nm6_l86.sdf
    4612 2020-05-08 17:41 test/pdb_ligands_sdf/4gkt_0o1.sdf
    4502 2020-05-08 17:41 test/pdb_ligands_sdf/3af4_gcp.sdf
    3785 2020-05-08 17:41 test/pdb_ligands_sdf/3iok_1p6.sdf
    7796 2020-05-08 17:41 test/pdb_ligands_sdf/1ivp_1zk.sdf
    1741 2020-05-08 17:41 test/pdb_ligands_sdf/2evd_d10.sdf
    4433 2020-05-08 17:41 test/pdb_ligands_sdf/4jsx_17g.sdf
    4884 2020-05-08 17:41 test/pdb_ligands_sdf/1y3v_uir.sdf
    3624 2020-05-08 17:41 test/pdb_ligands_sdf/5cqt_eb3.sdf
    4333 2020-05-08 17:41 test/pdb_ligands_sdf/4q1a_2xz.sdf
    4405 2020-05-08 17:41 test/pdb_ligands_sdf/5dt2_5ev.sdf
    4501 2020-05-08 17:41 test/pdb_ligands_sdf/5nk0_91e.sdf
    4111 2020-05-08 17:41 test/pdb_ligands_sdf/3lpf_z77.sdf
    4540 2020-05-08 17:41 test/pdb_ligands_sdf/5ifu_gbm.sdf
    4822 2020-05-08 17:41 test/pdb_ligands_sdf/3kkv_b99.sdf
    3051 2020-05-08 17:41 test/pdb_ligands_sdf/1xmy_rol.sdf
    4612 2020-05-08 17:41 test/pdb_ligands_sdf/4d7d_pkt.sdf
    1818 2020-05-08 17:41 test/pdb_ligands_sdf/3fuf_14o.sdf
    2809 2020-05-08 17:41 test/pdb_ligands_sdf/4uvg_a0c.sdf
    4177 2020-05-08 17:41 test/pdb_ligands_sdf/5eyc_5sz.sdf
    6338 2020-05-08 17:41 test/pdb_ligands_sdf/4uxu_mlk.sdf
    5885 2020-05-08 17:41 test/pdb_ligands_sdf/5b2y_w10.sdf
    2413 2020-05-08 17:41 test/pdb_ligands_sdf/3tzb_aa.sdf
    2259 2020-05-08 17:41 test/pdb_ligands_sdf/5eq1_bea.sdf
    2368 2020-05-08 17:41 test/pdb_ligands_sdf/4c1g_mco.sdf
    2038 2020-05-08 17:41 test/pdb_ligands_sdf/1dxo_dqn.sdf
    2364 2020-05-08 17:41 test/pdb_ligands_sdf/2bjm_anf.sdf
    1396 2020-05-08 17:41 test/pdb_ligands_sdf/1scq_cnh.sdf
    1922 2020-05-08 17:41 test/pdb_ligands_sdf/4y36_45l.sdf
    4026 2020-05-08 17:41 test/pdb_ligands_sdf/3mvz_bhn.sdf
    2870 2020-05-08 17:41 test/pdb_ligands_sdf/4b83_b3v.sdf
    1692 2020-05-08 17:41 test/pdb_ligands_sdf/3f88_2ht.sdf
    4255 2020-05-08 17:41 test/pdb_ligands_sdf/5ls1_73z.sdf
    4908 2020-05-08 17:41 test/pdb_ligands_sdf/6b0z_c81.sdf
    2842 2020-05-08 17:41 test/pdb_ligands_sdf/3pfp_036.sdf
    2951 2020-05-08 17:41 test/pdb_ligands_sdf/1s9p_des.sdf
    4587 2020-05-08 17:41 test/pdb_ligands_sdf/5lkj_6yb.sdf
    3997 2020-05-08 17:41 test/pdb_ligands_sdf/1a4q_dpc.sdf
    4961 2020-05-08 17:41 test/pdb_ligands_sdf/3wzj_o43.sdf
    2079 2020-05-08 17:41 test/pdb_ligands_sdf/4dzy_wj1.sdf
    2049 2020-05-08 17:41 test/pdb_ligands_sdf/2ay4_ppt.sdf
    4173 2020-05-08 17:41 test/pdb_ligands_sdf/2ycn_p61.sdf
    2632 2020-05-08 17:41 test/pdb_ligands_sdf/3zp4_tsa.sdf
    4284 2020-05-08 17:41 test/pdb_ligands_sdf/1nvs_ucm.sdf
    3650 2020-05-08 17:41 test/pdb_ligands_sdf/2ayp_43a.sdf
    4186 2020-05-08 17:41 test/pdb_ligands_sdf/3nw7_lgv.sdf
    4698 2020-05-08 17:41 test/pdb_ligands_sdf/2yig_5el.sdf
    3755 2020-05-08 17:41 test/pdb_ligands_sdf/3vf8_0je.sdf
    3204 2020-05-08 17:41 test/pdb_ligands_sdf/5etl_5rv.sdf
    3720 2020-05-08 17:41 test/pdb_ligands_sdf/2ihu_tp9.sdf
    3528 2020-05-08 17:41 test/pdb_ligands_sdf/5l1j_6og.sdf
    2773 2020-05-08 17:41 test/pdb_ligands_sdf/2no6_etv.sdf
    1951 2020-05-08 17:41 test/pdb_ligands_sdf/1s6h_4bz.sdf
    2836 2020-05-08 17:41 test/pdb_ligands_sdf/2nm3_mpu.sdf
    2617 2020-05-08 17:41 test/pdb_ligands_sdf/4f9b_0sy.sdf
    4113 2020-05-08 17:41 test/pdb_ligands_sdf/5xzg_aev.sdf
    4988 2020-05-08 17:41 test/pdb_ligands_sdf/4r5y_3k3.sdf
    3374 2020-05-08 17:41 test/pdb_ligands_sdf/4afj_sjj.sdf
    3308 2020-05-08 17:41 test/pdb_ligands_sdf/3oxt_3sb.sdf
    4276 2020-05-08 17:41 test/pdb_ligands_sdf/1f0t_pr1.sdf
    3735 2020-05-08 17:41 test/pdb_ligands_sdf/4u3b_3bw.sdf
    2636 2020-05-08 17:41 test/pdb_ligands_sdf/1zg8_l98.sdf
    2935 2020-05-08 17:41 test/pdb_ligands_sdf/4mjr_0la.sdf
    3193 2020-05-08 17:41 test/pdb_ligands_sdf/5v0v_8qs.sdf
    3651 2020-05-08 17:41 test/pdb_ligands_sdf/5kok_s9t.sdf
    4138 2020-05-08 17:41 test/pdb_ligands_sdf/1r1h_bir.sdf
    5105 2020-05-08 17:41 test/pdb_ligands_sdf/4qgf_32b.sdf
    2966 2020-05-08 17:41 test/pdb_ligands_sdf/5i0b_67u.sdf
    5247 2020-05-08 17:41 test/pdb_ligands_sdf/4ufg_d6j.sdf
    1734 2020-05-08 17:41 test/pdb_ligands_sdf/4ws2_6ua.sdf
    3336 2020-05-08 17:41 test/pdb_ligands_sdf/5hyk_65w.sdf
    3257 2020-05-08 17:41 test/pdb_ligands_sdf/4auj_hnw.sdf
    5220 2020-05-08 17:41 test/pdb_ligands_sdf/2iej_s48.sdf
    4486 2020-05-08 17:41 test/pdb_ligands_sdf/4z0l_4la.sdf
    3768 2020-05-08 17:41 test/pdb_ligands_sdf/4uvi_kxu.sdf
    3416 2020-05-08 17:41 test/pdb_ligands_sdf/5op8_a1h.sdf
    4793 2020-05-08 17:41 test/pdb_ligands_sdf/3is9_ac7.sdf
    3021 2020-05-08 17:41 test/pdb_ligands_sdf/4uvo_5ww.sdf
    4625 2020-05-08 17:41 test/pdb_ligands_sdf/2znp_k55.sdf
    4335 2020-05-08 17:41 test/pdb_ligands_sdf/3vs1_vsa.sdf
    4222 2020-05-08 17:41 test/pdb_ligands_sdf/3zhv_tdw.sdf
    5011 2020-05-08 17:41 test/pdb_ligands_sdf/3kdu_nks.sdf
    4601 2020-05-08 17:41 test/pdb_ligands_sdf/4h84_y38.sdf
    2684 2020-05-08 17:41 test/pdb_ligands_sdf/2x2w_x2w.sdf
    2064 2020-05-08 17:41 test/pdb_ligands_sdf/2ei1_d1n.sdf
    3829 2020-05-08 17:41 test/pdb_ligands_sdf/3zxh_e41.sdf
    4557 2020-05-08 17:41 test/pdb_ligands_sdf/4fes_0t9.sdf
    3846 2020-05-08 17:41 test/pdb_ligands_sdf/5f38_5ug.sdf
    3150 2020-05-08 17:41 test/pdb_ligands_sdf/3rhx_3rh.sdf
    3537 2020-05-08 17:41 test/pdb_ligands_sdf/1l4e_rbz.sdf
    4684 2020-05-08 17:41 test/pdb_ligands_sdf/1ksw_nbs.sdf
    5776 2020-05-08 17:41