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Diffusion constant of K(+) inside Gramicidin A: A comparative study of four computational methods

The local diffusion constant of K(+) inside the Gramicidin A (GA) channel has been calculated using four computational methods based on molecular dynamics (MD) simulations, specifically: Mean Square Displacement (MSD), Velocity Autocorrelation Function (VACF), Second Fluctuation Dissipation Theorem...

詳細記述

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書誌詳細
主要な著者: Mamonov, Artem B., Kurnikova, Maria G., Coalson, Rob D.
フォーマット: Artigo
言語:Inglês
出版事項: 2006
主題:
オンライン・アクセス:https://ncbi.nlm.nih.gov/pmc/articles/PMC2266632/
https://ncbi.nlm.nih.gov/pubmed/16797116
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1016/j.bpc.2006.03.019
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