Cargando...

Bayesian selection for coarse-grained models of liquid water

The necessity for accurate and computationally efficient representations of water in atomistic simulations that can span biologically relevant timescales has born the necessity of coarse-grained (CG) modeling. Despite numerous advances, CG water models rely mostly on a-priori specified assumptions....

Descrición completa

Gardado en:
Detalles Bibliográficos
Publicado en:Sci Rep
Main Authors: Zavadlav, Julija, Arampatzis, Georgios, Koumoutsakos, Petros
Formato: Artigo
Idioma:Inglês
Publicado: Nature Publishing Group UK 2019
Assuntos:
Acceso en liña:https://ncbi.nlm.nih.gov/pmc/articles/PMC6331618/
https://ncbi.nlm.nih.gov/pubmed/30643172
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1038/s41598-018-37471-0
Tags: Engadir etiqueta
Sen Etiquetas, Sexa o primeiro en etiquetar este rexistro!