David A. Pearlman

Publication Activity (10 Years)

Years Active: 1993-2021
Publications (10 Years): 3

Top Topics

Pharmaceutical Industry

Belief Propagation

Posterior Distribution

Top Venues

J. Chem. Inf. Model.

J. Comput. Aided Mol. Des.

Publications

Yuhang Wang, Sruthi Murlidaran, David A. Pearlman
enable high-quality scoring of diverse ligands. J. Comput. Aided Mol. Des. 35 (9) (2021)
Zoe Cournia, Bryce K. Allen, Thijs Beuming, David A. Pearlman, Brian K. Radak, Woody Sherman
Rigorous Free Energy Simulations in Virtual Screening. J. Chem. Inf. Model. 60 (9) (2020)
Tai-Sung Lee, Bryce K. Allen, Timothy J. Giese, Zhenyu Guo, Pengfei Li, Charles Lin, T. Dwight McGee, David A. Pearlman, Brian K. Radak, Yujun Tao, Hsu-Chun Tsai, Huafeng Xu, Woody Sherman, Darrin M. York
Alchemical Binding Free Energy Calculations in AMBER20: Advances and Best Practices for Drug Discovery. J. Chem. Inf. Model. 60 (11) (2020)
Christophe Chipot, Peter A. Kollman, David A. Pearlman
Alternative approaches to potential of mean force calculations: Free energy perturbation versus thermodynamic integration. Case study of some representative nonpolar interactions. J. Comput. Chem. 17 (9) (1996)
Stephen E. DeBolt, David A. Pearlman, Peter A. Kollman
Free Energy Peturbation Calculations on Parallel Computers: Demonstrations of Scalable Linear Speedup. J. Comput. Chem. 15 (3) (1994)
David A. Pearlman
Free Energy Derivatives: A New Method for Probing the Convergence Problem in Free Energy Calculations. J. Comput. Chem. 15 (1) (1994)
David A. Pearlman, Mark A. Murcko
drug suggestion. J. Comput. Chem. 14 (10) (1993)