Novel inhibitors to ADP ribose phosphatase of SARS-CoV-2 identified by structure-based high throughput virtual screening and molecular dynamics simulations. - Dhrumi C. Patel; Katherine R. Hausman; Muhammad Arba; Annie Tran; Phillip M. Lakernick; Chun Wu (Comput. Biol. Medicine, 2022)

Inhibition Mechanism of Anti-TB Drug SQ109: Allosteric Inhibition of TMM Translocation of Mycobacterium Tuberculosis MmpL3 Transporter. - Justin Carbone; Nicholas J. Paradis; Lucas Bennet; Mark C. Alesiani; Katherine R. Hausman; Chun Wu (J. Chem. Inf. Model., 2023)