Cargando…
Understanding Ligand Binding to G-Protein Coupled Receptors Using Multiscale Simulations
Human G-protein coupled receptors (GPCRs) convey a wide variety of extracellular signals inside the cell and they are one of the main targets for pharmaceutical intervention. Rational drug design requires structural information on these receptors; however, the number of experimental structures is sc...
Autores principales: | Alfonso-Prieto, Mercedes, Navarini, Luciano, Carloni, Paolo |
---|---|
Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
Frontiers Media S.A.
2019
|
Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6510167/ https://www.ncbi.nlm.nih.gov/pubmed/31131282 http://dx.doi.org/10.3389/fmolb.2019.00029 |
Ejemplares similares
-
Hybrid MM/CG Webserver: Automatic Set Up of Molecular Mechanics/Coarse-Grained Simulations for Human G Protein-Coupled Receptor/Ligand Complexes
por: Schneider, Jakob, et al.
Publicado: (2020) -
Agonist Binding to Chemosensory Receptors: A Systematic Bioinformatics Analysis
por: Fierro, Fabrizio, et al.
Publicado: (2017) -
Enhanced-Sampling Simulations for the Estimation of Ligand Binding Kinetics: Current Status and Perspective
por: Ahmad, Katya, et al.
Publicado: (2022) -
MiMiC: Multiscale Modeling in Computational Chemistry
por: Bolnykh, Viacheslav, et al.
Publicado: (2020) -
Editorial: Combining Simulations, Theory, and Experiments into Multiscale Models of Biological Events
por: Trovato, Fabio, et al.
Publicado: (2021)