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Implementation of residue-level coarse-grained models in GENESIS for large-scale molecular dynamics simulations

Residue-level coarse-grained (CG) models have become one of the most popular tools in biomolecular simulations in the trade-off between modeling accuracy and computational efficiency. To investigate large-scale biological phenomena in molecular dynamics (MD) simulations with CG models, unified treat...

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Detalles Bibliográficos
Autores principales: Tan, Cheng, Jung, Jaewoon, Kobayashi, Chigusa, Torre, Diego Ugarte La, Takada, Shoji, Sugita, Yuji
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Public Library of Science 2022
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9012402/
https://www.ncbi.nlm.nih.gov/pubmed/35381009
http://dx.doi.org/10.1371/journal.pcbi.1009578