chainer / chainer-chemistry

Chainer Chemistry: A Library for Deep Learning in Biology and Chemistry
MIT License
629 stars 131 forks source link

Chainer graph #398

Closed knshnb closed 5 years ago

knshnb commented 5 years ago

New features

Dataset class

Chemical Network
adjacency matrix NumpyTupleDataset PaddingGraphDataset
scatter operation SparseGraphDataset SparseGraphDataset
sparse matmul not supported PaddingGraphDataset (use_coo=True)
corochann commented 5 years ago

updated comment

corochann commented 5 years ago

updated comment

corochann commented 5 years ago

Thank you! LGTM. I will check to run example later!

codecov-io commented 5 years ago

Codecov Report

Merging #398 into master will decrease coverage by 6.81%. The diff coverage is 27.85%.

@@            Coverage Diff             @@
##           master     #398      +/-   ##
==========================================
- Coverage   91.22%   84.41%   -6.82%     
==========================================
  Files         229      234       +5     
  Lines       11049    11449     +400     
==========================================
- Hits        10080     9665     -415     
- Misses        969     1784     +815
corochann commented 5 years ago

@knshnb If you can add some test, please add test (coverage test is failing now, since new functionality is not tested.) But I am going to merge this PR, even though in current condition after I confirmed example code works.

corochann commented 5 years ago

I will merge this PR!

Known TODO: #400 #401