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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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Detalles Bibliográficos
Autores principales: Sharma, Vikas, Pattanaik, Kiran Kumar, Jayprakash, Venkatesan, Basu, Arijit, Mishra, Nibha
Formato: Texto
Lenguaje:English
Publicado: Biomedical Informatics 2009
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2825580/
https://www.ncbi.nlm.nih.gov/pubmed/20198176