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One-Dimensional Barrier-Preserving Free-Energy Projections of β-sheet Miniprotein: New Insights into the Folding Process

The conformational space of a 20-residue three-stranded antiparallel β-sheet peptide (double hairpin) was sampled by equilibrium folding/unfolding molecular dynamics simulations for a total of 20 µs. The resulting one-dimensional free-energy profiles (FEPs) provide a detailed description of the free...

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Detaylı Bibliyografya
Asıl Yazarlar: Krivov, Sergei V., Muff, Stefanie, Caflisch, Amedeo, Karplus, Martin
Materyal Türü: Artigo
Dil:Inglês
Baskı/Yayın Bilgisi: 2008
Konular:
Online Erişim:https://ncbi.nlm.nih.gov/pmc/articles/PMC2736680/
https://ncbi.nlm.nih.gov/pubmed/18590307
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/jp711864r
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