Commits · 48d8d6b53ab5cf8a48d6a5c6146fc26d7e8549cc · 钟慕尧 / deepchem

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Sep 26, 2017
- Cleaned UP · 48d8d6b5
  leswing authored Sep 26, 2017
  
  48d8d6b5
Sep 24, 2017
- Merge pull request #848 from peastman/prefetch · 5019ad5d
  Bharath Ramsundar authored Sep 23, 2017
  5019ad5d
Sep 23, 2017
- Change to work on Python 2 · da7cbcd5
  Peter Eastman authored Sep 22, 2017
  
  da7cbcd5
- Clean up pool properly · 5cb7f9af
  Peter Eastman authored Sep 22, 2017
  
  5cb7f9af
- Prefetch shards for DiskDataset · 4b9d9aff
  Peter Eastman authored Sep 22, 2017
  
  4b9d9aff
- Merge pull request #847 from peastman/fetches · 586871a1
  Bharath Ramsundar authored Sep 22, 2017
  586871a1
- Minor optimization to TensorGraph · 56fe2be5
  Peter Eastman authored Sep 22, 2017
  
  56fe2be5
Sep 22, 2017
- Merge pull request #828 from peastman/seq2seq · 20edb37c
  Bharath Ramsundar authored Sep 21, 2017
  20edb37c
- Merge pull request #840 from rbharath/error_bar · fe960807
  Bharath Ramsundar authored Sep 21, 2017
  fe960807
- Merge branch 'master' into seq2seq · d327b71e
  peastman authored Sep 21, 2017
  
  d327b71e
- Added test for notebook · e1b9624a
  peastman authored Sep 21, 2017
  
  e1b9624a
Sep 21, 2017
- Implemented KL cost annealing · 07123c7f
  peastman authored Sep 20, 2017
  
  07123c7f
Sep 20, 2017
- Added example for SeqToSeq fingerprint · b8f84490
  Peter Eastman authored Sep 19, 2017
  
  b8f84490
Sep 19, 2017
- Return embeddings as a numpy array · 73dd4b78
  peastman authored Sep 18, 2017
  
  73dd4b78
- Fixed error on Python 2 · 2753d5ff
  peastman authored Sep 18, 2017
  
  2753d5ff
- Changed API to do prediction in bulk · 354ccf61
  peastman authored Sep 18, 2017
  
  354ccf61
Sep 18, 2017
- Graphconv error bar fix · 359f2db8
  Bharath Ramsundar authored Sep 17, 2017
  
  359f2db8
Sep 14, 2017
- Bug fix · 3b8bc043
  peastman authored Sep 13, 2017
  
  3b8bc043
Sep 13, 2017
- Can use SeqToSeq as a variational autoencoder · d471172e
  peastman authored Sep 12, 2017
  
  d471172e
Sep 12, 2017
- Merge pull request #833 from miguelroboso/fixed_padded_predict · 65d2b7c5
  Bharath Ramsundar authored Sep 11, 2017
  65d2b7c5
- yapfed models/tensorgraph/models/graph_models.py · 3c605f15
  michele donato authored Sep 11, 2017
  
  3c605f15
- fixes batch padding in predict: pad_batches was always "True", now it follows... · e313c5bd
  michele donato authored Sep 11, 2017
  e313c5bd
Sep 09, 2017
- Merge pull request #829 from kmckiern/dataset_prep_tutorial · 908a0919
  Bharath Ramsundar authored Sep 08, 2017
  908a0919
- tweaked text - fixed typos, changed deepchem to DeepChem, added author credit · 5484e77f
  kmckiern authored Sep 08, 2017
  
  5484e77f
- yapf-ed · e9725200
  kmckiern authored Sep 08, 2017
  
  e9725200
Sep 08, 2017
- correct number of blank lines · 35135799
  Keri A. McKiernan authored Sep 08, 2017
  
  35135799
- for automatic installation of dependencies · 74ef2fcf
  kmckiern authored Sep 07, 2017
  
  74ef2fcf
- dependencies for dataset_preparation tutorial · 5dde9089
  kmckiern authored Sep 07, 2017
  
  5dde9089
- add dataset_preparation notebook test · bc071b3c
  kmckiern authored Sep 07, 2017
  
  bc071b3c
- fix file paths · 7339d171
  kmckiern authored Sep 07, 2017
  
  7339d171
- supplementary file for dataset_preparation tutorial · 62bb4e9f
  kmckiern authored Sep 07, 2017
  
  62bb4e9f
- for rendering the notebook on the website · d39bb03c
  kmckiern authored Sep 07, 2017
  
  d39bb03c
- add example experimental dataset · eee948ff
  kmckiern authored Sep 07, 2017
  
  eee948ff
- Tutorial detailing the creation of a deepchem dataset from novel data · 4faa801b
  kmckiern authored Sep 07, 2017
  
  4faa801b
- Continuing to implement SeqToSeq · 8392f55f
  peastman authored Sep 07, 2017
  
  8392f55f
Sep 07, 2017
- Merge branch 'master' into seq2seq · 2609b33f
  peastman authored Sep 06, 2017
  
  2609b33f
- Continuing to implement SeqToSeq · ec2a06d0
  peastman authored Sep 06, 2017
  
  ec2a06d0
Sep 06, 2017
- Merge pull request #823 from lilleswing/save-ani1 · 7dec6843
  Bharath Ramsundar authored Sep 06, 2017
  7dec6843
- yapf · 7b056ed6
  leswing authored Sep 06, 2017
  
  7b056ed6
- master merge · 877d95f1
  leswing authored Sep 06, 2017
  
  877d95f1

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Commits · 48d8d6b53ab5cf8a48d6a5c6146fc26d7e8549cc