DockingApp RF: A State-of-the-Art Novel Scoring Function for Molecular Docking in a User-Friendly Interface to AutoDock Vina

Motivation: Bringing a new drug to the market is expensive and time-consuming. To cut the costs and time, computer-aided drug design (CADD) approaches have been increasingly included in the drug discovery pipeline. However, despite traditional docking tools show a good conformational space sampling...

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Detalles Bibliográficos
Autores principales: Macari, Gabriele, Toti, Daniele, Pasquadibisceglie, Andrea, Polticelli, Fabio
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2020
Materias:
Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7765429/
https://www.ncbi.nlm.nih.gov/pubmed/33333976
http://dx.doi.org/10.3390/ijms21249548

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7765429/
https://www.ncbi.nlm.nih.gov/pubmed/33333976
http://dx.doi.org/10.3390/ijms21249548

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