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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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| Main Authors: | , , , , , |
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| 格式: | Artigo |
| 語言: | Inglês |
| 出版: |
Biophysical Society
2007
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| 主題: | |
| 在線閱讀: | 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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