Kirk E. Hevener

Comparison of radii sets, entropy, QM methods, and sampling on MM‐PBSA, MM‐GBSA, and QM/MM‐GBSA ligand binding energies of F. tularensis enoyl‐ACP reductase (FabI)

Pin-Chih Su, Cheng-Chieh Tsai, Shahila Mehboob, 2015, J. Comput. Chem..

Validation of Molecular Docking Programs for Virtual Screening against Dihydropteroate Synthase

Wei Zhao, Kirk E. Hevener, Stephen W. White, 2009, J. Chem. Inf. Model..

Fragment-Based Drug Discovery Using a Multidomain, Parallel MD-MM/PBSA Screening Protocol

Kirk E. Hevener, Michael E. Johnson, Hyun Lee, 2013, J. Chem. Inf. Model..

A statistical framework to evaluate virtual screening

Wei Zhao, Kirk E. Hevener, James M. Boyett, 2009, BMC Bioinformatics.