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Ion Permeation Through a Phospholipid Membrane: Transition State, Path Splitting, and Calculation of Permeability
We investigate the thermodynamics and kinetics of the permeation of a potassium ion through a phospholipid membrane. We illustrate that the conventional reaction coordinate (the position of the ion along the normal to the membrane plane) is insufficient to capture essential elements of the process....
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| Publicado no: | J Chem Theory Comput |
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| Main Authors: | , |
| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado em: |
2018
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| Assuntos: | |
| Acesso em linha: | https://ncbi.nlm.nih.gov/pmc/articles/PMC6467798/ https://ncbi.nlm.nih.gov/pubmed/30474968 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/acs.jctc.8b00882 |
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