Binding Free-Energy Calculation Is a Powerful Tool for Drug Optimization: Calculation and Measurement of Binding Free Energy for 7-Azaindole Derivatives to Glycogen Synthase Kinase-3β.
Kunihiro KitamuraYunoshin TamuraTomokazu UekiKoji OgataShigeho NodaRyutaro HimenoHiroshi ChumanPublished in: J. Chem. Inf. Model. (2014)