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A utility script for automating and integrating AutoDock and other associated programs for virtual screening.

AutoDock is one of the most widely used docking programs but, is under utilized for the purpose of virtual screening. In order to overcome the difficulties that arise during virtual screening with AutoDock especially for GUI users an attempt is taken to automate the entire docking process, starting...

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Auteurs principaux: Sharma, Vikas, Pattanaik, Kiran Kumar, Jayprakash, Venkatesan, Basu, Arijit, Mishra, Nibha
Format: Artigo
Langue:Inglês
Publié: Biomedical Informatics 2009
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Accès en ligne:https://ncbi.nlm.nih.gov/pmc/articles/PMC2825580/
https://ncbi.nlm.nih.gov/pubmed/20198176
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