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Error and efficiency of simulated tempering simulations
We derive simple analytical expressions for the error and computational efficiency of simulated tempering (ST) simulations. The theory applies to the important case of systems whose dynamics at long times is dominated by the slow interconversion between two metastable states. An extension to the mul...
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| Autors principals: | , |
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| Format: | Artigo |
| Idioma: | Inglês |
| Publicat: |
U.S. Government
2010
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| Matèries: | |
| Accés en línia: | https://ncbi.nlm.nih.gov/pmc/articles/PMC2821152/ https://ncbi.nlm.nih.gov/pubmed/20095723 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1063/1.3290767 |
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