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Sensitivity of the folding/unfolding transition state ensemble of chymotrypsin inhibitor 2 to changes in temperature and solvent

To better characterize the transition state for folding/unfolding and its sensitivity to environmental changes, we have run multiple molecular dynamics simulations of chymotrypsin inhibitor 2 (CI2) under varying solvent conditions and temperature. The transition state structures agree well with expe...

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Detalhes bibliográficos
Main Authors: Day, Ryan, Daggett, Valerie
Formato: Artigo
Idioma:Inglês
Publicado em: Cold Spring Harbor Laboratory Press 2005
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC2253282/
https://ncbi.nlm.nih.gov/pubmed/15840831
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1110/ps.041226005
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