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Simulations of the pressure and temperature unfolding of an α-helical peptide
We study by molecular simulations the reversible folding/unfolding equilibrium as a function of density and temperature of a solvated α-helical peptide. We use an extension of the replica exchange molecular dynamics method that allows for density and temperature Monte Carlo exchange moves. We studie...
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| Main Authors: | , , |
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| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado em: |
National Academy of Sciences
2005
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| Assuntos: | |
| Acesso em linha: | https://ncbi.nlm.nih.gov/pmc/articles/PMC1100754/ https://ncbi.nlm.nih.gov/pubmed/15800045 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1073/pnas.0408527102 |
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