Metadynamics simulations leveraged by statistical analyses and artificial intelligence-based tools to inform the discovery of G protein-coupled receptor ligands

G Protein-Coupled Receptors (GPCRs) are a large family of membrane proteins with pluridimensional signaling profiles. They undergo ligand-specific conformational changes, which in turn lead to the differential activation of intracellular signaling proteins and the consequent triggering of a variety...

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Detalles Bibliográficos
Autores principales: Salas-Estrada, Leslie, Fiorillo, Bianca, Filizola, Marta
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Frontiers Media S.A. 2022
Materias:
Endocrinology
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9816996/
https://www.ncbi.nlm.nih.gov/pubmed/36619585
http://dx.doi.org/10.3389/fendo.2022.1099715

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9816996/
https://www.ncbi.nlm.nih.gov/pubmed/36619585
http://dx.doi.org/10.3389/fendo.2022.1099715

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