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Theory and Practice of Coarse-Grained Molecular Dynamics of Biologically Important Systems

Molecular dynamics with coarse-grained models is nowadays extensively used to simulate biomolecular systems at large time and size scales, compared to those accessible to all-atom molecular dynamics. In this review article, we describe the physical basis of coarse-grained molecular dynamics, the coa...

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Detalles Bibliográficos
Autores principales: Liwo, Adam, Czaplewski, Cezary, Sieradzan, Adam K., Lipska, Agnieszka G., Samsonov, Sergey A., Murarka, Rajesh K.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2021
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8465211/
https://www.ncbi.nlm.nih.gov/pubmed/34572559
http://dx.doi.org/10.3390/biom11091347