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Characterization of Folding Mechanisms of Trp-cage and WW-domain by Network Analysis of Simulations with a Hybrid-resolution Model

In this study, we apply a hybrid-resolution model, namely PACE, to characterize the free energy surfaces (FESs) of trp-cage and a WW domain variant along with the respective folding mechanisms. Unbiased, independent simulations with PACE are found to achieve together multiple folding and unfolding e...

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Detalhes bibliográficos
Main Authors: Han, Wei, Schulten, Klaus
Formato: Artigo
Idioma:Inglês
Publicado em: 2013
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC3811923/
https://ncbi.nlm.nih.gov/pubmed/23915394
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/jp404331d
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