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binding_affinity

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binding_affinity / data /all.parquet

Commit History

make smiles canonical

9737168

jglaser commited on Jul 5, 2021

normalize affinities

85bd2ca

jglaser commited on May 27, 2021

remove outliers

5225bab

jglaser commited on May 27, 2021

add parquet file

89a844e

jglaser commited on May 25, 2021