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Multiscale Macromolecular Simulation: Role of Evolving Ensembles

Multiscale analysis provides an algorithm for the efficient simulation of macromolecular assemblies. This algorithm involves the coevolution of a quasiequilibrium probability density of atomic configurations and the Langevin dynamics of spatial coarse-grained variables denoted order parameters (OPs)...

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Sonraí Bibleagrafaíochta
Main Authors: Singharoy, A., Joshi, H., Ortoleva, P.J.
Formáid: Artigo
Teanga:Inglês
Foilsithe: 2012
Ábhair:
Rochtain Ar Líne:https://ncbi.nlm.nih.gov/pmc/articles/PMC3721968/
https://ncbi.nlm.nih.gov/pubmed/22978601
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/ci3002952
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