Pocket2Drug: An Encoder-Decoder Deep Neural Network for the Target-Based Drug Design

Computational modeling is an essential component of modern drug discovery. One of its most important applications is to select promising drug candidates for pharmacologically relevant target proteins. Because of continuing advances in structural biology, putative binding sites for small organic mole...

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Detalles Bibliográficos
Autores principales: Shi, Wentao, Singha, Manali, Srivastava, Gopal, Pu, Limeng, Ramanujam, J., Brylinski, Michal
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Frontiers Media S.A. 2022
Materias:
Pharmacology
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8962739/
https://www.ncbi.nlm.nih.gov/pubmed/35359869
http://dx.doi.org/10.3389/fphar.2022.837715

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8962739/
https://www.ncbi.nlm.nih.gov/pubmed/35359869
http://dx.doi.org/10.3389/fphar.2022.837715

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