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The role of water and protein flexibility in the structure-based virtual screening of allosteric GPCR modulators: an mGlu(5) receptor case study

Stabilizing unique receptor conformations, allosteric modulators of G-protein coupled receptors (GPCRs) might open novel treatment options due to their new pharmacological action, their enhanced specificity and selectivity in both binding and signaling. Ligand binding occurs at intrahelical alloster...

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Detalhes bibliográficos
Publicado no:J Comput Aided Mol Des
Main Authors: Orgován, Zoltán, Ferenczy, György G., Keserű, György M.
Formato: Artigo
Idioma:Inglês
Publicado em: Springer International Publishing 2019
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC6825653/
https://ncbi.nlm.nih.gov/pubmed/31542869
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1007/s10822-019-00224-w
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