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Modeling kinetics and equilibrium of membranes with fields: Milestoning analysis and implication to permeation

Coarse graining of membrane simulations by translating atomistic dynamics to densities and fields with Milestoning is discussed. The space of the membrane system is divided into cells and the different cells are characterized by order parameters presenting the number densities. The dynamics of the o...

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Библиографические подробности
Главные авторы: Cardenas, Alfredo E., Elber, Ron
Формат: Artigo
Язык:Inglês
Опубликовано: American Institute of Physics 2014
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Online-ссылка:https://ncbi.nlm.nih.gov/pmc/articles/PMC4119198/
https://ncbi.nlm.nih.gov/pubmed/25106564
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1063/1.4891305
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