Title : Multiple Molecular Dynamics Simulations of the Inhibitor GRL-02031 Complex with Wild Type and Mutant HIV-1 Protease Reveal the Binding and Drug-Resistance Mechanism.

Pub. Date : 2020 Nov 24

PMID : 33175558






1 Functional Relationships(s)
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1 Analyses of the hydrogen bonds and atomic interactions further provided detailed explanations for the resistance of these four mutation proteases toward inhibitor GRL-02031. Hydrogen nuclear receptor subfamily 3 group C member 1 Homo sapiens