B.S. and M.S. in chemistry, Peking University, China
Ph.D. in computational chemistry, University of Pennsylvania, PA
- Ph.D.
Education & Training
Center Affiliation(s)
Computational Genomic Screening Center
Research Interests
- Drug Discovery and Development
- Drug Formulations and Delivery
- Drug Abuse and Prevention
Research / Project
• Coarse-grained force field development for drug-delivery systems
• AMBER & GAFF force field development.
• Protein-ligand binding free energy calculation.
• Computer-aided drug design.
• Simulations of intrinsically disordered proteins such as tau proteins for Alzheimer’s disease.
• Participating in the SAMPL9 Host-Guest Blind Challenge (2021) and SAMPL9 LogP Blind Challenge (2022)
• Participating in the 2017 Drug Design Data Resource (D3R) Grand Challenge
• AMBER & GAFF force field development.
• Protein-ligand binding free energy calculation.
• Computer-aided drug design.
• Simulations of intrinsically disordered proteins such as tau proteins for Alzheimer’s disease.
• Participating in the SAMPL9 Host-Guest Blind Challenge (2021) and SAMPL9 LogP Blind Challenge (2022)
• Participating in the 2017 Drug Design Data Resource (D3R) Grand Challenge
Recent Publications
