ChemInform Abstract: Prediction of Potency of Protease Inhibitors Using Free Energy Simulations with Polarizable Quantum Mechanics-Based Ligand Charges and a Hybrid Water Model.
Debananda Das, Yasuhiro Koh, Yasushi Tojo, Arun K. Ghosh, Hiroaki MitsuyaVolume:
41
Year:
2010
Pages:
1
DOI:
10.1002/chin.201014185
File:
PDF, 15 KB
2010