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Using Equation-Free Computation to Accelerate Network-Free Stochastic Simulation of Chemical Kinetics

The chemical kinetics of many complex systems can be concisely represented by reaction rules, which can be used to generate reaction events via a kinetic Monte Carlo method that has been termed network-free simulation. Here, we demonstrate accelerated network-free simulation through a novel approach...

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Pubblicato in:J Phys Chem B
Autori principali: Lin, Yen Ting, Chylek, Lily A., Lemons, Nathan W., Hlavacek, William S.
Natura: Artigo
Lingua:Inglês
Pubblicazione: 2018
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Accesso online:https://ncbi.nlm.nih.gov/pmc/articles/PMC6050008/
https://ncbi.nlm.nih.gov/pubmed/29851484
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/acs.jpcb.8b02960
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