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Statistics for the analysis of molecular dynamics simulations: providing P values for agonist-dependent GPCR activation
Molecular dynamics (MD) is the common computational technique for assessing efficacy of GPCR-bound ligands. Agonist efficacy measures the capability of the ligand-bound receptor of reaching the active state in comparison with the free receptor. In this respect, agonists, neutral antagonists and inve...
Autores principales: | , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
Nature Publishing Group UK
2020
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7672096/ https://www.ncbi.nlm.nih.gov/pubmed/33203907 http://dx.doi.org/10.1038/s41598-020-77072-4 |