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Commits on Feb 21, 2022

• Update LICENSE

  atfrank

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• Updated to GNU GPL v 3.0 LICENSE

  atfrank

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Commits on Jan 28, 2022

• Update README.md

  atfrank

  authored
  6b9e12e

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Commits on Sep 27, 2021

• roll back to rdkit=09.3 for compatibility

  Truman-Xu

  committed
  136271a

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• fixed generator handling on return None

  Truman-Xu

  committed
  c2d5d83

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Commits on Sep 23, 2021

• python 3.7 dependency added

  Truman-Xu

  committed
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Commits on Sep 2, 2021

• Update README.md

  Truman-Xu

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  88a0991

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• Update README.md

  Truman-Xu

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Commits on Jun 24, 2021

• dependencies got rid of pip

  Truman-Xu

  committed
  4a7a166

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• downgraded rdkit to 2020.09.5 avoid bugs

  Truman-Xu

  committed
  72e60e3

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Commits on Jun 17, 2021

• Update README.md

  Truman-Xu

  authored
  1e21947

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• Update README.md

  Truman-Xu

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  2a517ff

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• Update README.md

  Truman-Xu

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Commits on Jun 7, 2021

• Update README.md

  atfrank

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  dc9f604

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Commits on Jun 2, 2021

• Change init import sequence

  Truman-Xu

  committed
  44a4845

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Commits on May 30, 2021

• changed file type

  

  Aaron T. Frank

  committed
  cab0b78

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• Create CDK2.md

  

  Aaron T. Frank

  committed
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Commits on May 25, 2021

• Update README.md

  atfrank

  authored
  a1d8def

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• Delete LICENSE_COMMERICAL

  atfrank

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  36824d6

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Commits on May 11, 2021

• fix setup.py parameter error

  Truman-Xu

  committed
  cf212f4

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• extended ensemble feature

  Truman-Xu

  committed
  6b1f4f7

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Commits on May 4, 2021

• remove submodules

  Truman-Xu

  committed
  cf41799

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• Merge branch 'master' of github.com:atfrank/SampleDock

  Truman-Xu

  committed
  16b2c38

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• updated param file format

  Truman-Xu

  committed
  139aa46

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• implemented ensemble and minor bug fix

  Truman-Xu

  committed
  f274d1b

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Commits on Apr 27, 2021

• chang pip dependecies listing

  Truman-Xu

  authored
  5af5ee3

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Commits on Apr 21, 2021

• add tmap plot code

  Truman-Xu

  committed
  d73b101

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• Bug fix on tmap plotter

  Truman-Xu

  committed
  6e6d520

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• Bug fix on tmap plotter

  Truman-Xu

  committed
  eb39739

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• Bug fix on tmap plotter

  Truman-Xu

  committed
  438599f

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• tmap plotting implemented

  Truman-Xu

  committed
  3f576f5

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Commits on Apr 11, 2021

• Update setup.py

  atfrank

  authored
  e1ef375

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Commits on Mar 30, 2021

• Update LICENSE_NON-COMMERICAL

  atfrank

  authored
  0de9a0c

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• Update LICENSE_COMMERICAL

  atfrank

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  9e99f20

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• Delete LICENSE

  atfrank

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