A Deep-Learning Approach toward Rational Molecular Docking Protocol Selection

While a plethora of different protein–ligand docking protocols have been developed over the past twenty years, their performances greatly depend on the provided input protein–ligand pair. In this study, we developed a machine-learning model that uses a combination of convolutional and fully connecte...

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Detalles Bibliográficos
Autores principales: Jiménez-Luna, José, Cuzzolin, Alberto, Bolcato, Giovanni, Sturlese, Mattia, Moro, Stefano
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2020
Materias:
Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7321124/
https://www.ncbi.nlm.nih.gov/pubmed/32471211
http://dx.doi.org/10.3390/molecules25112487

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7321124/
https://www.ncbi.nlm.nih.gov/pubmed/32471211
http://dx.doi.org/10.3390/molecules25112487

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