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Protein Structure and Dynamics in Nonaqueous Solvents: Insights from Molecular Dynamics Simulation Studies

Protein structure and dynamics in nonaqueous solvents are here investigated using molecular dynamics simulation studies, by considering two model proteins (ubiquitin and cutinase) in hexane, under varying hydration conditions. Ionization of the protein groups is treated assuming “pH memory,” i.e., u...

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Detalhes bibliográficos
Main Authors: Soares, Cláudio M., Teixeira, Vitor H., Baptista, António M.
Formato: Artigo
Idioma:Inglês
Publicado em: Biophysical Society 2003
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC1302733/
https://ncbi.nlm.nih.gov/pubmed/12609866
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