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A journey through mapping space: characterising the statistical and metric properties of reduced representations of macromolecules

ABSTRACT: A mapping of a macromolecule is a prescription to construct a simplified representation of the system in which only a subset of its constituent atoms is retained. As the specific choice of the mapping affects the analysis of all-atom simulations as well as the construction of coarse-graine...

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Detalles Bibliográficos
Autores principales: Menichetti, Roberto, Giulini, Marco, Potestio, Raffaello
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Springer Berlin Heidelberg 2021
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8550479/
https://www.ncbi.nlm.nih.gov/pubmed/34720709
http://dx.doi.org/10.1140/epjb/s10051-021-00205-9