Virtual Screening for HIV Protease Inhibitors: A Comparison of AutoDock 4 and Vina
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منابع مشابه
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 programs were used to rank the members of two chemical libraries, each containing experimentally veri...
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ژورنال
عنوان ژورنال: PLoS ONE
سال: 2010
ISSN: 1932-6203
DOI: 10.1371/journal.pone.0011955