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; Kirk E. Hevener; Michael E. Johnson (J. Comput. Chem., 2015)

Evaluating thermodynamic integration performance of the new amber molecular dynamics package and assess potential halogen bonds of enoyl-ACP reductase (FabI) benzimidazole inhibitors. - Pin-Chih Su; Michael E. Johnson (J. Comput. Chem., 2016)