Interaction of I50V Mutant and I50L/A71V Double Mutant HIV-Protease with Inhibitor TMC114 (Darunavir): Molecular Dynamics Simulation and Binding Free Energy Studies

Title
Interaction of I50V Mutant and I50L/A71V Double Mutant HIV-Protease with Inhibitor TMC114 (Darunavir): Molecular Dynamics Simulation and Binding Free Energy Studies
Authors
Keywords
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Journal
JOURNAL OF PHYSICAL CHEMISTRY B
Volume 116, Issue 6, Pages 1884-1900
Publisher
American Chemical Society (ACS)
Online
2012-01-13
DOI
10.1021/jp2074804

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