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chainer
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chainer-chemistry
Chainer Chemistry: A Library for Deep Learning in Biology and Chemistry
MIT License
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add mark.slow flag in test_flow_scaler
#379
corochann
closed
4 years ago
10
Add flexci
#378
mottodora
closed
4 years ago
11
test for chainer v6
#377
corochann
closed
4 years ago
1
Chainerx dev
#376
corochann
closed
4 years ago
8
numpy seems to be missing in install_requires
#375
yurivict
closed
4 years ago
2
fix pandas and rdkit import error on Docker
#374
cks-coil
closed
4 years ago
0
AutoPrintReport
#373
corochann
closed
4 years ago
1
Fix gwm
#372
corochann
closed
4 years ago
1
use graph_mlp
#371
corochann
closed
4 years ago
1
use label_scaler
#370
corochann
closed
4 years ago
1
How to use weavenet?
#369
sorenwacker
closed
4 years ago
2
Unify GWM, modules args/kwargs
#368
corochann
closed
4 years ago
2
Refactoring Graph Warp Module
#367
corochann
closed
4 years ago
0
Graph film
#366
mist714
closed
4 years ago
5
Reduce container image size
#365
zaltoprofen
closed
5 years ago
3
add Dockerfile
#364
cks-coil
closed
5 years ago
0
prediction values changing with a number of input molecules
#363
sleeper2173
opened
5 years ago
3
How to output predicted values?
#362
TaTKSM
opened
5 years ago
6
added kwargs
#361
corochann
closed
5 years ago
0
Bug fix: Weave preprocessor
#360
corochann
closed
5 years ago
0
allow_pickle=True
#359
corochann
closed
5 years ago
1
fix typo MolVisualier, shape_transformer_2d
#358
ghost
closed
5 years ago
0
fix typo in test
#357
ghost
closed
5 years ago
0
fix typo
#356
ghost
closed
5 years ago
1
[WIP] example: rewrite to use chainerx
#355
corochann
closed
4 years ago
1
[WIP] ChainerX
#354
corochann
closed
4 years ago
2
added development plan to README
#353
corochann
closed
5 years ago
1
support Path instance json encoding
#352
corochann
closed
5 years ago
2
Min max scaler
#351
corochann
closed
5 years ago
1
Max abs scaler
#350
corochann
closed
5 years ago
1
experimental commit
#349
corochann
closed
5 years ago
1
Scaler axis
#348
corochann
closed
5 years ago
3
scaler forward, __call__ support
#347
corochann
closed
5 years ago
1
Schnet add h
#346
mist714
closed
4 years ago
7
Refactor GIN
#345
natsukium
closed
5 years ago
1
Add path
#344
natsukium
closed
5 years ago
1
Add unified GraphConvModel
#343
mottodora
closed
4 years ago
1
Implement SparseGGNN
#342
ir5
closed
5 years ago
6
About atoms 3D geometry and distance matrix for QM9 dataset
#341
xptree
closed
5 years ago
2
Refactoring Graph Warp Module
#340
mottodora
closed
4 years ago
4
Fix the type of return value from R2 Score Evaluator
#339
mottodora
closed
5 years ago
4
fix import & docstring
#338
corochann
closed
5 years ago
2
fix gin.py
#337
TaizoAyase
closed
5 years ago
1
Move setup predictor to Library
#336
natsukium
closed
5 years ago
2
Why does evaluation of tox21 models use not test dataset but validation dataset?
#335
tamuhey
closed
5 years ago
3
[WIP] Cora dataset
#334
natsukium
closed
4 years ago
2
Add typing module
#333
natsukium
closed
5 years ago
1
Add some documents
#332
mottodora
closed
5 years ago
1
Add document checker
#331
mottodora
closed
5 years ago
3
Fix readthedocs environment
#330
mottodora
closed
5 years ago
1
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