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Multiconfigurational Coarse-Grained Molecular Dynamics

[Image: see text] Standard low resolution coarse-grained modeling techniques have difficulty capturing multiple configurations of protein systems. Here, we present a method for creating accurate coarse-grained (CG) models with multiple configurations using a linear combination of functions or “state...

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Detalles Bibliográficos
Autores principales:	Sharp, Morris E., Vázquez, Francisco X., Wagner, Jacob W., Dannenhoffer-Lafage, Thomas, Voth, Gregory A.
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	American Chemical Society 2019
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6660024/ https://www.ncbi.nlm.nih.gov/pubmed/30897328 http://dx.doi.org/10.1021/acs.jctc.8b01133

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