Commits · a642246ad633d51d78ad7f85b115d1b32b1272fc · 钟慕尧 / deepchem

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Apr 13, 2017
- Add in data files · a642246a
  Bharath Ramsundar authored Apr 12, 2017
  
  a642246a
- Merge branch 'master' of https://github.com/pandegroup/deepchem into vina_tf · 82cd3fae
  Bharath Ramsundar authored Apr 12, 2017
  
  82cd3fae
- Merge pull request #514 from lilleswing/download-data · 82658299
  Bharath Ramsundar authored Apr 12, 2017
  82658299
- Merge pull request #513 from rbharath/numpy_select · 09452829
  Bharath Ramsundar authored Apr 12, 2017
  09452829
- Merge pull request #512 from patrickhop/master · 35956bec
  Bharath Ramsundar authored Apr 12, 2017
  35956bec
- EZ download script · 0cfe905c
  leswing authored Apr 12, 2017
  
  0cfe905c
- EZ download script · ae47dfa4
  leswing authored Apr 12, 2017
  
  ae47dfa4
Apr 12, 2017
- Some dataset utilities · f5ff588e
  Bharath Ramsundar authored Apr 11, 2017
  
  f5ff588e
- +mpnn · d7e28be2
  patrickhop authored Apr 12, 2017
  
  d7e28be2
- +mpnn · 7b4c513b
  patrickhop authored Apr 12, 2017
  
  7b4c513b
- Merge pull request #511 from lilleswing/atomic-convs · 2920bc29
  Bharath Ramsundar authored Apr 11, 2017
  2920bc29
- YAPF · 4712adac
  leswing authored Apr 11, 2017
  
  4712adac
- Turn it into a prediction · f69999e1
  leswing authored Apr 11, 2017
  
  f69999e1
- Small bugfixes for atomic convs · 81593ded
  leswing authored Apr 11, 2017
  
  81593ded
Apr 11, 2017
- Merge pull request #481 from miaecle/torch · 71f4abe2
  Bharath Ramsundar authored Apr 10, 2017
  71f4abe2
- GPU porting · 69c627e1
  miaecle authored Apr 10, 2017
  
  69c627e1
- examples and yapfed · 2f605d77
  miaecle authored Apr 10, 2017
  
  2f605d77
- Merge remote-tracking branch 'remotes/origin/master' into torch · 120bdde4
  miaecle authored Apr 10, 2017
  
  120bdde4
- moving into contrib folder · c73082f1
  miaecle authored Apr 10, 2017
  
  c73082f1
- Merge pull request #509 from joegomes/acdc · 24e248f5
  Bharath Ramsundar authored Apr 10, 2017
  24e248f5
- MIT update · 54cc2e25
  Joseph Gomes authored Apr 10, 2017
  
  54cc2e25
- Atomic convolutional networks and scripts · 66a175a9
  Joseph Gomes authored Apr 10, 2017
  
  66a175a9
Apr 08, 2017
- Merge pull request #508 from DorisMai/patch-1 · 6fc4a46b
  Bharath Ramsundar authored Apr 07, 2017
  6fc4a46b
Apr 07, 2017
- small update on readme.md · b63c9387
  DorisMai authored Apr 06, 2017
  b63c9387
- Merge pull request #505 from lilleswing/tg-graphconv-cr · b5a3f977
  Bharath Ramsundar authored Apr 06, 2017
  b5a3f977
- Revert Graph Conv For tox21 · 79655a7e
  leswing authored Apr 06, 2017
  
  79655a7e
- Formatting · b45b0373
  leswing authored Apr 06, 2017
  
  b45b0373
- CR updates · 641a5c42
  leswing authored Apr 06, 2017
  
  641a5c42
Apr 06, 2017
- Merge pull request #504 from miaecle/weave · 472eeece
  Bharath Ramsundar authored Apr 05, 2017
  472eeece
- Merge pull request #506 from lilleswing/lazy-import · 5ed5afae
  Bharath Ramsundar authored Apr 05, 2017
  5ed5afae
- Formatting · 1d8a4d54
  leswing authored Apr 05, 2017
  
  1d8a4d54
- Formatting · 904b278a
  leswing authored Apr 05, 2017
  
  904b278a
- Lazy Import · 268c6810
  leswing authored Apr 05, 2017
  
  268c6810
- Better GraphConvs · 44b2c473
  leswing authored Apr 05, 2017
  
  44b2c473
- Merge remote-tracking branch 'remotes/mine/weave' into weave · 8488e279
  miaecle authored Apr 05, 2017
  
  8488e279
- update gaussian membership function · 94489f71
  miaecle authored Apr 05, 2017
  
  94489f71
Apr 05, 2017
- yapfed · 882feccf
  miaecle authored Apr 04, 2017
  
  882feccf
- add source · 959cbe27
  miaecle authored Apr 04, 2017
  
  959cbe27
- weave model first draft · d69e919c
  miaecle authored Apr 04, 2017
  
  d69e919c
Apr 04, 2017
- fixing bugs · 8731ebf8
  miaecle authored Apr 04, 2017
  
  8731ebf8

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Commits · a642246ad633d51d78ad7f85b115d1b32b1272fc