Protein–ligand binding with the coarse-grained Martini model

The detailed understanding of the binding of small molecules to proteins is the key for the development of novel drugs or to increase the acceptance of substrates by enzymes. Nowadays, computer-aided design of protein–ligand binding is an important tool to accomplish this task. Current approaches ty...

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Detalles Bibliográficos
Autores principales: Souza, Paulo C. T., Thallmair, Sebastian, Conflitti, Paolo, Ramírez-Palacios, Carlos, Alessandri, Riccardo, Raniolo, Stefano, Limongelli, Vittorio, Marrink, Siewert J.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Nature Publishing Group UK 2020
Materias:
Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7382508/
https://www.ncbi.nlm.nih.gov/pubmed/32709852
http://dx.doi.org/10.1038/s41467-020-17437-5

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7382508/
https://www.ncbi.nlm.nih.gov/pubmed/32709852
http://dx.doi.org/10.1038/s41467-020-17437-5

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