Načítá se...

Replica exchange with nonequilibrium switches

We introduce a replica exchange (parallel tempering) method in which attempted configuration swaps are generated using nonequilibrium work simulations. By effectively increasing phase space overlap, this approach mitigates the need for many replicas. We illustrate our method by using a model system...

Celý popis

Uloženo v:
Podrobná bibliografie
Hlavní autoři: Ballard, Andrew J., Jarzynski, Christopher
Médium: Artigo
Jazyk:Inglês
Vydáno: National Academy of Sciences 2009
Témata:
On-line přístup:https://ncbi.nlm.nih.gov/pmc/articles/PMC2718341/
https://ncbi.nlm.nih.gov/pubmed/19592512
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1073/pnas.0900406106
Tagy: Přidat tag
Žádné tagy, Buďte první, kdo otaguje tento záznam!