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DINC-COVID: A webserver for ensemble docking with flexible SARS-CoV-2 proteins

An unprecedented research effort has been undertaken in response to the ongoing COVID-19 pandemic. This has included the determination of hundreds of crystallographic structures of SARS-CoV-2 proteins, and numerous virtual screening projects searching large compound libraries for potential drug inhi...

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Detalles Bibliográficos
Autores principales: Hall-Swan, Sarah, Devaurs, Didier, Rigo, Mauricio M., Antunes, Dinler A., Kavraki, Lydia E., Zanatta, Geancarlo
Formato: Online Artículo Texto
Lenguaje:English
Publicado: The Authors. Published by Elsevier Ltd. 2021
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8518241/
https://www.ncbi.nlm.nih.gov/pubmed/34717233
http://dx.doi.org/10.1016/j.compbiomed.2021.104943