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Correlation between Virtual Screening Performance and Binding Site Descriptors of Protein Targets

Rescoring is a simple approach that theoretically could improve the original docking results. In this study AutoDock Vina was used as a docked engine and three other scoring functions besides the original scoring function, Vina, as well as their combinations as consensus scoring functions were emplo...

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Detalles Bibliográficos
Autor principal: Shamsara, Jamal
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Hindawi 2018
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5818911/
https://www.ncbi.nlm.nih.gov/pubmed/29545955
http://dx.doi.org/10.1155/2018/3829307