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Charge Delocalization in Proton Channels, I: The Aquaporin Channels and Proton Blockage

The explicit contribution to the free energy barrier and proton conductance from the delocalized nature of the excess proton is examined in aquaporin channels using an accurate all-atom molecular dynamics computer simulation model. In particular, the channel permeation free energy profiles are calcu...

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書誌詳細
主要な著者: Chen, Hanning, Ilan, Boaz, Wu, Yujie, Zhu, Fangqiang, Schulten, Klaus, Voth, Gregory A.
フォーマット: Artigo
言語:Inglês
出版事項: Biophysical Society 2007
主題:
オンライン・アクセス:https://ncbi.nlm.nih.gov/pmc/articles/PMC1697834/
https://ncbi.nlm.nih.gov/pubmed/17056733
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1529/biophysj.106.091934
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