Commits · b2e09efc4366905eb57b9dc7d3091f048a561204 · 钟慕尧 / deepchem

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Nov 23, 2018
- Merge pull request #1456 from rbharath/six_soft · b2e09efc
  Bharath Ramsundar authored Nov 22, 2018
  b2e09efc
- Changes · 647e45d8
  Bharath Ramsundar authored Nov 22, 2018
  
  647e45d8
- Merge pull request #1455 from rbharath/dnasim_soft · 767ed31a
  Bharath Ramsundar authored Nov 22, 2018
  767ed31a
- Another change · 69d71f1b
  Bharath Ramsundar authored Nov 22, 2018
  
  69d71f1b
- bugfix · 456143d7
  Bharath Ramsundar authored Nov 22, 2018
  
  456143d7
- dnasim cleanup · a2ecb397
  Bharath Ramsundar authored Nov 22, 2018
  
  a2ecb397
- Merge pull request #1454 from rbharath/rdkit_soft · f6e80071
  Bharath Ramsundar authored Nov 22, 2018
  f6e80071
Nov 22, 2018
- bugfixes · 4880f2aa
  Bharath Ramsundar authored Nov 21, 2018
  
  4880f2aa
- Merge pull request #1447 from christabella/issue/1185-sdf-loading-without-csv · 1d57213d
  Bharath Ramsundar authored Nov 21, 2018
  1d57213d
- changes · 1f6e10d5
  Bharath Ramsundar authored Nov 21, 2018
  
  1f6e10d5
- changes · 659631da
  Bharath Ramsundar authored Nov 21, 2018
  
  659631da
- Partial cleanup · 9ce499f2
  Bharath Ramsundar authored Nov 21, 2018
  
  9ce499f2
- remove · 05278185
  Bharath Ramsundar authored Nov 21, 2018
  
  05278185
- changes · c294a6e7
  Bharath Ramsundar authored Nov 21, 2018
  
  c294a6e7
Nov 19, 2018
- Run yapf -i :crying-cat-face: · dfac79f3
  Christabella Irwanto authored Nov 19, 2018
  
  dfac79f3
- Merge pull request #1452 from peastman/pad · 2a72d8e1
  Bharath Ramsundar authored Nov 18, 2018
  2a72d8e1
Nov 17, 2018
- pad_batch() correctly handles labels with more than two dimensions · dc222769
  Peter Eastman authored Nov 16, 2018
  
  dc222769
Nov 16, 2018
- Handle backwards compatibility where .sdf.csv exists storing tasks · 896cc659
  Christabella Irwanto authored Nov 16, 2018
  
  896cc659
Nov 15, 2018
- Merge pull request #1450 from peastman/bugs · 9219d4ed
  Bharath Ramsundar authored Nov 14, 2018
  9219d4ed
Nov 14, 2018
- Fixed calculation of convolution output shape · 8a1ad36d
  peastman authored Nov 13, 2018
  
  8a1ad36d
- Fixed errors in computing layer output shapes and loading images · d5dad129
  Peter Eastman authored Nov 13, 2018
  
  d5dad129
Nov 11, 2018
- If no CSV supplied, read task directly from .sdf with mol.getProp() · 130e98dd
  Christabella Irwanto authored Nov 10, 2018
  
  130e98dd
Nov 10, 2018
- Pass tasks into load_sdf_files so we can extract tasks from .sdf · ff31d0a7
  Christabella Irwanto authored Nov 10, 2018
  
  ff31d0a7
Nov 06, 2018
- Merge pull request #1445 from peastman/dr · cce55b72
  Bharath Ramsundar authored Nov 05, 2018
  cce55b72
- Diabetic retinopathy example supports saliency mapping · 5603e51f
  peastman authored Nov 05, 2018
  
  5603e51f
Oct 31, 2018
- Merge pull request #1439 from peastman/imagedataset · 92f679e5
  Bharath Ramsundar authored Oct 30, 2018
  92f679e5
Oct 27, 2018
- Fixes to support ImageDataset · ffeb4b7c
  peastman authored Oct 26, 2018
  
  ffeb4b7c
Oct 26, 2018
- ImageLoader.featurize() returns an ImageDataset · 9fb18d53
  peastman authored Oct 25, 2018
  
  9fb18d53
- Created ImageDataset · 1cb76ba4
  peastman authored Oct 25, 2018
  
  1cb76ba4
- Merge pull request #1432 from VIGS25/fix-pdbbind-notebook · 787bffa4
  Bharath Ramsundar authored Oct 25, 2018
  787bffa4
- Merge pull request #1433 from VIGS25/get-layer-weights · 14956580
  Bharath Ramsundar authored Oct 25, 2018
  14956580
- Merge pull request #1437 from miaecle/master · fa42240f
  Bharath Ramsundar authored Oct 25, 2018
  fa42240f
Oct 25, 2018
- fix for python3 incompatibility · c72de7a4
  miaecle authored Oct 24, 2018
  
  c72de7a4
Oct 17, 2018
- Fixed testing errors · 4e7d5adb
  Vignesh authored Oct 17, 2018
  
  4e7d5adb
- Added tests; Added missing warnings import in layers.py · c9c38037
  Vignesh authored Oct 16, 2018
  
  c9c38037
Oct 16, 2018
- Added get_layer_weights to tensorgraph · c5c96e34
  Vignesh authored Oct 16, 2018
  
  c5c96e34
Oct 15, 2018
- Fix reproducibility issues with pdbbind notebook; return pdbbind_tasks instead of tasks · 8e644c5d
  Vignesh authored Oct 15, 2018
  
  8e644c5d
- Merge pull request #1431 from VIGS25/fix-pdbbind-grid-loader · 25e38a21
  Bharath Ramsundar authored Oct 14, 2018
  25e38a21
Oct 13, 2018
- fixed indentation error · c8ce9325
  Vignesh authored Oct 13, 2018
  
  c8ce9325
Oct 10, 2018
- Merge BEDROC metric · 902b14f1
  Vignesh Ram Somnath authored Oct 09, 2018
  902b14f1

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Commits · b2e09efc4366905eb57b9dc7d3091f048a561204