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A Computer Simulation Study of the Hydrated Proton in a Synthetic Proton Channel

Classical molecular dynamics simulations using the multistate empirical valence bond model for aqueous proton transport were performed to characterize the hydration structure of an excess proton inside a leucine-serine synthetic ion channel, LS2. For such a nonuniform pore size ion channel, it is fo...

Ausführliche Beschreibung

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Bibliographische Detailangaben
Hauptverfasser: Wu, Yujie, Voth, Gregory A.
Format: Artigo
Sprache:Inglês
Veröffentlicht: Biophysical Society 2003
Schlagworte:
Online Zugang:https://ncbi.nlm.nih.gov/pmc/articles/PMC1303208/
https://ncbi.nlm.nih.gov/pubmed/12885634
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