deepchem / moleculenet

Moleculenet.ai Datasets And Splits
MIT License
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Two Submissions on BACE Regression #17

Closed mufeili closed 3 years ago

mufeili commented 3 years ago

@rbharath @miaecle This PR is for two submissions (random forest + ECFP & GCN + GC) on BACE regression.

mufeili commented 3 years ago

@rbharath I think this is ready and you may merge it.