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Computational Prediction of Alanine Scanning and Ligand Binding Energetics in G-Protein Coupled Receptors

Site-directed mutagenesis combined with binding affinity measurements is widely used to probe the nature of ligand interactions with GPCRs. Such experiments, as well as structure-activity relationships for series of ligands, are usually interpreted with computationally derived models of ligand bindi...

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Detalles Bibliográficos
Autores principales: Boukharta, Lars, Gutiérrez-de-Terán, Hugo, Åqvist, Johan
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Public Library of Science 2014
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3990513/
https://www.ncbi.nlm.nih.gov/pubmed/24743773
http://dx.doi.org/10.1371/journal.pcbi.1003585

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