Commits · 7a53caec37602bff2870d30a5c5dd6162fec693b · 钟慕尧 / deepchem

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Oct 05, 2017
- tests for several functions defined in rdkit_grid_featurizer · 7a53caec
  marta-sd authored Oct 05, 2017
  
  7a53caec
- FIX: removed dots from file formats in get_ligand_filetype · 1567da22
  marta-sd authored Oct 05, 2017
  
  1567da22
Oct 03, 2017
- Merge pull request #855 from peastman/submodel · f27a3fdf
  Bharath Ramsundar authored Oct 03, 2017
  f27a3fdf
- Merge pull request #860 from lilleswing/858-badweave · 2745d99d
  Bharath Ramsundar authored Oct 03, 2017
  2745d99d
- More attempts at fixing tests · babd9621
  peastman authored Oct 02, 2017
  
  babd9621
- Merge branch 'master' into submodel · 85568f87
  peastman authored Oct 02, 2017
  
  85568f87
- Merge branch 'master' into 858-badweave · 5f1e2eb3
  leswing authored Oct 02, 2017
  
  5f1e2eb3
- Trying to correct merge · c0ecc4dc
  peastman authored Oct 02, 2017
  
  c0ecc4dc
- Merge pull request #839 from proteneer/ani_trans_int · 64d3ba49
  Bharath Ramsundar authored Oct 02, 2017
  64d3ba49
- Merge branch 'master' into submodel · 95b30f86
  peastman authored Oct 02, 2017
  
  95b30f86
- Fixed error in Python 2 · 1b418b30
  peastman authored Oct 02, 2017
  
  1b418b30
- yapf and cleanup · 74414af3
  Yutong Zhao authored Oct 02, 2017
  
  74414af3
- Fixed failing test case · ac3e86e8
  peastman authored Oct 02, 2017
  
  ac3e86e8
- Fix numerical problems with gradient by adding a very small delta · be07198b
  Yutong Zhao authored Oct 02, 2017
  
  be07198b
- Fix Tests · 003c685c
  leswing authored Oct 02, 2017
  
  003c685c
- Try documentation again · 3f3ec446
  leswing authored Oct 02, 2017
  
  3f3ec446
Oct 02, 2017
- Documentation on Layer Splitter · d3dc29fa
  leswing authored Oct 02, 2017
  
  d3dc29fa
Sep 30, 2017
- Created CGAN example · 0ad056ff
  peastman authored Sep 29, 2017
  
  0ad056ff
- Remove non-existant imports · bb1a590f
  leswing authored Sep 29, 2017
  
  bb1a590f
- Created Divide layer · a03a6328
  peastman authored Sep 29, 2017
  
  a03a6328
- GOGO · 9a459f34
  leswing authored Sep 29, 2017
  
  9a459f34
- Fix more tests · ef5bea10
  Yutong Zhao authored Sep 29, 2017
  
  ef5bea10
- Merge branch 'master' into 858-badweave · b1700271
  leswing authored Sep 29, 2017
  
  b1700271
- Fix test_overfit · 0f3a46f8
  Yutong Zhao authored Sep 29, 2017
  
  0f3a46f8
Sep 29, 2017
- Quick fix · cad7ec0a
  Yutong Zhao authored Sep 29, 2017
  
  cad7ec0a
- yapf · ba2e0a4c
  Yutong Zhao authored Sep 29, 2017
  
  ba2e0a4c
- Merge branch 'master' into ani_trans_int · f5d04605
  Yutong Zhao authored Sep 29, 2017
  
  f5d04605
- Use self interaction energies directly from paper · cabf2708
  Yutong Zhao authored Sep 29, 2017
  
  cabf2708
- Merge pull request #859 from Dgelemi/untargz_function · 7b6248db
  Bharath Ramsundar authored Sep 28, 2017
  7b6248db
- Merge pull request #851 from lilleswing/graphconvsuch-cr · 2031c49d
  Bharath Ramsundar authored Sep 28, 2017
  2031c49d
- Save via numpy · d52c0b9d
  Yutong Zhao authored Sep 28, 2017
  
  d52c0b9d
- readability · 604e7830
  leswing authored Sep 28, 2017
  
  604e7830
- Merge pull request #857 from lilleswing/libicui18n · bf419fb2
  Bharath Ramsundar authored Sep 28, 2017
  bf419fb2
Sep 28, 2017
- Make sure can reload · 4708ba13
  leswing authored Sep 28, 2017
  
  4708ba13
- Weave single out_tensor · af33de9c
  leswing authored Sep 28, 2017
  
  af33de9c
- lilleswing comment · 8fce9969
  Jérémy authored Sep 28, 2017
  
  8fce9969
- Weave only one out_layer · d39add8a
  leswing authored Sep 28, 2017
  
  d39add8a
- file encoding · 0cda26f5
  leswing authored Sep 28, 2017
  
  0cda26f5
- Remove extra print · a5033e34
  Yutong Zhao authored Sep 28, 2017
  
  a5033e34
- Merge branch 'master' into graphconvsuch-cr · 90320cba
  leswing authored Sep 28, 2017
  
  90320cba

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Commits · 7a53caec37602bff2870d30a5c5dd6162fec693b