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Free-energy landscape of glycerol permeation through aquaglyceroporin GlpF determined from steered molecular dynamics simulations

The free-energy landscape of glycerol permeation through the aquaglyceroporin GlpF has been estimated in the literature by the nonequilibrium method of steered molecular dynamics (SMD) simulations and by the equilibrium method of adaptive biasing force (ABF) simulations. However, the ABF results qua...

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Detalhes bibliográficos
Autor principal: Chen, L. Y.
Formato: Artigo
Idioma:Inglês
Publicado em: 2010
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC2926166/
https://ncbi.nlm.nih.gov/pubmed/20573441
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1016/j.bpc.2010.05.014
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