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Simulations of β-hairpin folding confined to spherical pores using distributed computing

We report the thermodynamics and kinetics of an off-lattice Go model β-hairpin from Ig-binding protein confined to an inert spherical pore. Confinement enhances the stability of the hairpin due to the decrease in the entropy of the unfolded state. Compared with their values in the bulk, the rates of...

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Detalles Bibliográficos
Main Authors: Klimov, D. K., Newfield, D., Thirumalai, D.
Formato: Artigo
Idioma:Inglês
Publicado: The National Academy of Sciences 2002
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Acceso en liña:https://ncbi.nlm.nih.gov/pmc/articles/PMC123013/
https://ncbi.nlm.nih.gov/pubmed/12060748
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1073/pnas.072220699
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