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Dissipative particle dynamics model of homogalacturonan based on molecular dynamics simulations

In this study we present an alternative dissipative particle dynamics (DPD) parametrization strategy based on data extracted from the united-atom molecular simulations. The model of the homogalacturonan was designed to test the ability of the formation of large-scale structures via hydrogen bonding...

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Detalles Bibliográficos
Autores principales: Pieczywek, P. M., Płaziński, W., Zdunek, A.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Nature Publishing Group UK 2020
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7477560/
https://www.ncbi.nlm.nih.gov/pubmed/32895471
http://dx.doi.org/10.1038/s41598-020-71820-2