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Native contacts determine protein folding mechanisms in atomistic simulations

The recent availability of long equilibrium simulations of protein folding in atomistic detail for more than 10 proteins allows us to identify the key interactions driving folding. We find that the collective fraction of native amino acid contacts, Q, captures remarkably well the transition states f...

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Detalhes bibliográficos
Main Authors: Best, Robert B., Hummer, Gerhard, Eaton, William A.
Formato: Artigo
Idioma:Inglês
Publicado em: National Academy of Sciences 2013
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC3816414/
https://ncbi.nlm.nih.gov/pubmed/24128758
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1073/pnas.1311599110
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