Commits · a94fa1d346661c7e2b8ae658f573e9ff4ea93403 · 钟慕尧 / deepchem · GitLab

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Apr 16, 2021
- Reformat test_gcn.py with yapf 0.22 · a94fa1d3
  Atreya Majumdar authored Apr 16, 2021
  
  a94fa1d3
Apr 15, 2021
- Updated deepchem/docs/source/models.rst with HuberLoss · b20651c4
  Atreya Majumdar authored Apr 15, 2021
  
  b20651c4
Apr 14, 2021
- Added detail to huber loss comment · 49107dda
  Atreya Majumdar authored Apr 14, 2021
  
  49107dda
- Fixed Formatting · 169805fd
  Atreya Majumdar authored Apr 14, 2021
  
  169805fd
- Removed redundant files · 4391109c
  Atreya Majumdar authored Apr 14, 2021
  
  4391109c
- Added Huber code again · 30b20294
  Atreya Majumdar authored Apr 14, 2021
  
  30b20294
- Formatting changes · 487bc3cb
  Atreya Majumdar authored Apr 14, 2021
  
  487bc3cb
- Added Huber loss and relevant torch+TF tests · e7d390ef
  Atreya Majumdar authored Apr 14, 2021
  
  e7d390ef
- Merge pull request #2466 from PascalIversen/master · 9de39778
  Bharath Ramsundar authored Apr 13, 2021
  9de39778
- Merge pull request #2473 from atreyamaj/atreya · 2e4b30fc
  Bharath Ramsundar authored Apr 13, 2021
  2e4b30fc
- Fixed Graph Convolution Featurizers - MolGanFeaturizer · c9b2d3ff
  Atreya Majumdar authored Apr 13, 2021
  
  c9b2d3ff
Apr 13, 2021
- Merge pull request #2471 from alat-rights/patch-1 · 2c0d75df
  Bharath Ramsundar authored Apr 12, 2021
  2c0d75df
- Updated release note · 0412c1dc
  alat-rights authored Apr 13, 2021
  
  0412c1dc
- Updated · f7c89198
  alat-rights authored Apr 13, 2021
  
  f7c89198
- Merge pull request #2460 from JainSamyak8840/master · 8eb7b764
  Bharath Ramsundar authored Apr 12, 2021
  8eb7b764
- Merge pull request #2469 from alat-rights/master · 70a132de
  Bharath Ramsundar authored Apr 12, 2021
  70a132de
Apr 12, 2021
- Added updating website to release instructions · c67bb40d
  alat-rights authored Apr 12, 2021
  
  c67bb40d
Apr 08, 2021
- add img_size parameter to ChemCeption model · 3ca99af3
  Pascal authored Apr 08, 2021
  
  3ca99af3
- Merge pull request #1 from deepchem/master · e422b9b8
  Pascal authored Apr 08, 2021
  e422b9b8
Apr 07, 2021
- Merge pull request #2442 from PascalIversen/master · ab5fa059
  Bharath Ramsundar authored Apr 06, 2021
  ab5fa059
- Merge pull request #2462 from mufeili/fix_molnet · 3b892827
  Bharath Ramsundar authored Apr 06, 2021
  3b892827
- Merge pull request #2446 from NinadBhat/issue_2067_sdf_loader_zip_files · 374cec58
  Bharath Ramsundar authored Apr 06, 2021
  374cec58
Apr 06, 2021
- Run all tests even if some fail (#2461) · a834e726
  Peter Eastman authored Apr 06, 2021
  a834e726
- Merge pull request #2458 from alat-rights/onehot · e613643b
  Bharath Ramsundar authored Apr 05, 2021
  e613643b
Apr 03, 2021
- Merge pull request #2463 from peastman/pearson · 361207f8
  Peter Eastman authored Apr 02, 2021
  361207f8
- Remove trailing whitespace in comments, flake8. · 198233c2
  alat-rights authored Apr 03, 2021
  
  198233c2
- Further clarification on the comment · 820574c4
  alat-rights authored Apr 03, 2021
  
  820574c4
- Modified comment on one_hot according to Peter's suggestion · 86e19cbc
  alat-rights authored Apr 03, 2021
  
  86e19cbc
- Slight edit to unit tests for clarity · 5943f0ab
  alat-rights authored Apr 03, 2021
  
  5943f0ab
- Fixed typo, 'smile' -> 'SMILES' · 947e2b69
  alat-rights authored Apr 03, 2021
  
  947e2b69
- Merge pull request #2445 from seyonechithrananda/chemberta-tutorial · a3c3874c
  Bharath Ramsundar authored Apr 02, 2021
  a3c3874c
Apr 02, 2021
- Changed parent class to Featurizer · 5f649d9f
  alat-rights authored Apr 02, 2021
  
  5f649d9f
- Fixed docstring · 80ba9072
  Peter Eastman authored Apr 01, 2021
  
  80ba9072
- Fixed error in computing Pearson correlation coefficient · 0f972098
  Peter Eastman authored Apr 01, 2021
  
  0f972098
- Update clearance_datasets.py · 2ff85193
  Mufei Li authored Apr 02, 2021
  
  2ff85193
- Update hppb_datasets.py · b9c1fb38
  Mufei Li authored Apr 02, 2021
  
  b9c1fb38
- Merge pull request #5 from deepchem/master · 6aad136f
  Mufei Li authored Apr 02, 2021
  6aad136f
Apr 01, 2021
- Fixed stylistic problems suggested by Bharath · 285bc538
  alat-rights authored Apr 01, 2021
  
  285bc538
- Documentation change · 22933d68
  alat-rights authored Apr 01, 2021
  
  22933d68
- Minor bug fix · 77695d5f
  alat-rights authored Apr 01, 2021
  
  77695d5f

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