Dual Inhibitors for Aspartic Proteases HIV-1 PR and Renin: Advancements in AIDS–Hypertension–Diabetes Linkage via Molecular Dynamics, Inhibition Assays, and Binding Free Energy Calculations

Author:

Tzoupis Haralambos12,Leonis Georgios1,Megariotis Grigorios13,Supuran Claudiu T.4,Mavromoustakos Thomas2,Papadopoulos Manthos G.1

Affiliation:

1. Institute of Organic and Pharmaceutical Chemistry, National Hellenic Research Foundation, 48 Vas. Constantinou Avenue, Athens 11635, Greece

2. Department of Chemistry, National and Kapodistrian University of Athens, Panepistimioupolis Zographou, Athens 15771, Greece

3. School of Chemical Engineering, National Technical University of Athens, 9 Heroon Polytechniou Street, Athens 15780, Greece

4. Department of Chemistry, University of Florence, Via della Lastruccia 3, Rm 18, 50019 Sesto Fiorentino (Florence), Italy

Publisher

American Chemical Society (ACS)

Subject

Drug Discovery,Molecular Medicine

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