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snap-stanford / ogb

Benchmark datasets, data loaders, and evaluators for graph machine learning
https://ogb.stanford.edu
MIT License
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add removeHs in mols.py #444

Closed v-shaoningli closed 1 year ago

v-shaoningli commented 1 year ago

add removeHs params in smiles2graph function to alter adding H when converting SMILES to graphs (features).