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Virtual Screening for HIV Protease Inhibitors: A Comparison of AutoDock 4 and Vina

BACKGROUND: The AutoDock family of software has been widely used in protein-ligand docking research. This study compares AutoDock 4 and AutoDock Vina in the context of virtual screening by using these programs to select compounds active against HIV protease. METHODOLOGY/PRINCIPAL FINDINGS: Both prog...

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Detalles Bibliográficos
Autores principales: Chang, Max W., Ayeni, Christian, Breuer, Sebastian, Torbett, Bruce E.
Formato: Texto
Lenguaje:English
Publicado: Public Library of Science 2010
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2915912/
https://www.ncbi.nlm.nih.gov/pubmed/20694138
http://dx.doi.org/10.1371/journal.pone.0011955