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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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| Natura: | Artigo |
| Lingua: | Inglês |
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2010
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| Accesso online: | 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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