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Phylogeny of protein-folding trajectories reveals a unique pathway to native structure

To scrutinize how a protein folds at atomic resolution, we performed 200 molecular dynamics simulations (each of 50 ns) of the miniprotein Trp-cage on the computational grid. Within the trajectories, 58 folding and 31 unfolding events were identified and subjected to extensive comparison and classif...

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Detalhes bibliográficos
Main Authors: Ota, Motonori, Ikeguchi, Mitsunori, Kidera, Akinori
Formato: Artigo
Idioma:Inglês
Publicado em: National Academy of Sciences 2004
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC539736/
https://ncbi.nlm.nih.gov/pubmed/15591340
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1073/pnas.0407015102
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