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TIGER2: An improved algorithm for temperature intervals with global exchange of replicas

An empirical sampling method for molecular simulation based on “temperature intervals with global exchange of replicas” (TIGER2) has been developed to reduce the high demand for computational resources and the low computational efficiency of the conventional replica-exchange molecular dynamics (REMD...

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Detalhes bibliográficos
Principais autores: Li, Xianfeng, Latour, Robert A., Stuart, Steven J.
Formato: Artigo
Idioma:Inglês
Publicado em: American Institute of Physics 2009
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC2719473/
https://ncbi.nlm.nih.gov/pubmed/19425768
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1063/1.3129342
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