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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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| Main Authors: | , , |
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| Format: | Artigo |
| Jezik: | Inglês |
| Izdano: |
2012
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| Teme: | |
| Online dostop: | 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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