PEP-FOLD4: a pH-dependent force field for peptide structure prediction in aqueous solution

Accurate and fast structure prediction of peptides of less 40 amino acids in aqueous solution has many biological applications, but their conformations are pH- and salt concentration-dependent. In this work, we present PEP-FOLD4 which goes one step beyond many machine-learning approaches, such as Al...

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Detalles Bibliográficos
Autores principales: Rey, Julien, Murail, Samuel, de Vries, Sjoerd, Derreumaux, Philippe, Tuffery, Pierre
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Oxford University Press 2023
Materias:
Web Server Issue
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10320157/
https://www.ncbi.nlm.nih.gov/pubmed/37166962
http://dx.doi.org/10.1093/nar/gkad376

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10320157/
https://www.ncbi.nlm.nih.gov/pubmed/37166962
http://dx.doi.org/10.1093/nar/gkad376

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