Modeling the Bioactivation and Subsequent Reactivity of Drugs
Published in Chemical Research in Toxicology, 2021
Publications
Significance of Multiple Bioactivation Pathways for Meclofenamate as Revealed through Modeling and Reaction Kinetics
Published in Drug Metabolism and Disposition, 2020
Meloxicam methyl group determines enzyme specificity for thiazole bioactivation compared to sudoxicam
Published in Toxicology Letters, 2020
The Metabolic Forest: Predicting the Diverse Structures of Drug Metabolites
Published in Journal of Chemical Information and Modeling, 2020
XenoNet: Inference and Likelihood of Intermediate Metabolite Formation
Published in Journal of Chemical Information and Modeling, 2020
Dual mechanisms suppress meloxicam bioactivation relative to sudoxicam
Published in Toxicology, 2020
Comprehensive kinetic and modeling analyses revealed CYP2C9 and 3A4 determine terbinafine metabolic clearance and bioactivation
Published in Biochemical Pharmacology, 2019
CYP2C19 and 3A4 Dominate Metabolic Clearance and Bioactivation of Terbinafine Based on Computational and Experimental Approaches
Published in Chemical Research in Toxicology, 2019