Shape-Restrained Modeling of Protein–Small-Molecule Complexes with High Ambiguity Driven DOCKing

[Image: see text] Small-molecule docking remains one of the most valuable computational techniques for the structure prediction of protein–small-molecule complexes. It allows us to study the interactions between compounds and the protein receptors they target at atomic detail in a timely and efficie...

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Detalles Bibliográficos
Autores principales: Koukos, Panagiotis I., Réau, Manon, Bonvin, Alexandre M. J. J.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2021
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8479858/
https://www.ncbi.nlm.nih.gov/pubmed/34436890
http://dx.doi.org/10.1021/acs.jcim.1c00796

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8479858/
https://www.ncbi.nlm.nih.gov/pubmed/34436890
http://dx.doi.org/10.1021/acs.jcim.1c00796

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