ChemistryAtlas Dataset

LIT-PCBA

Protein-ligand and dockingvirtual screeningbioassaybenchmark
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Literature-derived protein-ligand virtual screening benchmark designed to reduce analogue bias.

Category: Protein-ligand and docking.

Citation: Tran-Nguyen et al., J Chem Inf Model 2020.

TypeDataset
DomainProtein-ligand and docking
LicenseOpen research dataset
ContributorsLIT-PCBA team