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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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Detalhes bibliográficos
Main Authors: Sharma, Vikas, Pattanaik, Kiran Kumar, Jayprakash, Venkatesan, Basu, Arijit, Mishra, Nibha
Formato: Artigo
Idioma:Inglês
Publicado em: Biomedical Informatics 2009
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC2825580/
https://ncbi.nlm.nih.gov/pubmed/20198176
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