An open source chemical structure curation pipeline using RDKit

A. PatrĂ­cia Bento, Anne Hersey, Eloy Felix, Gregory A. Landrum, Anna Gaulton, Francis Atkinson, Louisa J. Bellis, Marleen De Veij, Andrew R. Leach. An open source chemical structure curation pipeline using RDKit. J. Cheminformatics, 12(1):51, 2020. [doi]

Abstract

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