Tautomer Standardization in Chemical Databases: Deriving Business Rules from Quantum Chemistry

Christopher M. Baker, Nathan J. Kidley, Konstantinos Papachristos, Matthew Hotson, Rob Carson, David Gravestock, Martin Pouliot, Jim Harrison, Alan Dowling. Tautomer Standardization in Chemical Databases: Deriving Business Rules from Quantum Chemistry. Journal of Chemical Information and Computer Sciences, 60(8):3781-3791, 2020. [doi]

Abstract

Abstract is missing.