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Rate Constant and Reaction Coordinate of Trp-Cage Folding in Explicit Water
We report rate constant calculations and a reaction coordinate analysis of the rate-limiting folding and unfolding process of the Trp-cage mini-protein in explicit solvent using transition interface sampling. Previous transition path sampling simulations revealed that in this (un)folding process the...
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| Autores principales: | , |
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| Formato: | Artigo |
| Lenguaje: | Inglês |
| Publicado: |
The Biophysical Society
2008
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| Materias: | |
| Acceso en línea: | https://ncbi.nlm.nih.gov/pmc/articles/PMC2567936/ https://ncbi.nlm.nih.gov/pubmed/18676648 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1529/biophysj.108.136267 |
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