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2020 – today
- 2023
[j5]Jinhong Ren
, Tasneem M. Vaid, Hyun Lee, Isabel Ojeda, Michael E. Johnson:
Evaluation of interactions between the hepatitis C virus NS3/4A and sulfonamidobenzamide based molecules using molecular docking, molecular dynamics simulations and binding free energy calculations. J. Comput. Aided Mol. Des. 37(1): 53-65 (2023)
2010 – 2019
- 2016
- [j4]Pin-Chih Su, Michael E. Johnson:
Evaluating thermodynamic integration performance of the new amber molecular dynamics package and assess potential halogen bonds of enoyl-ACP reductase (FabI) benzimidazole inhibitors. J. Comput. Chem. 37(9): 836-847 (2016) - 2015
- [j3]Pin-Chih Su, Cheng-Chieh Tsai, Shahila Mehboob, Kirk E. Hevener, Michael E. Johnson:
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). J. Comput. Chem. 36(25): 1859-1873 (2015) - 2013
- [j2]Tian Zhu, Hyun Lee, Hao Lei, Christopher Jones, Kavankumar Patel, Michael E. Johnson, Kirk E. Hevener:
Fragment-Based Drug Discovery Using a Multidomain, Parallel MD-MM/PBSA Screening Protocol. J. Chem. Inf. Model. 53(3): 560-572 (2013) - 2012
- [j1]Rima Chaudhuri, Hyun Lee, Lena Truong, Jaime Torres, Kavankumar Patel, Michael E. Johnson:
Identification of Non-Macrocyclic Small Molecule Inhibitors against the NS3/4A Serine Protease of Hepatitis C Virus through in Silico Screening. J. Chem. Inf. Model. 52(8): 2245-2256 (2012)
Coauthor Index
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