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Correlation analysis for heat denaturation of Trp‐cage miniprotein with explicit solvent

Energetics was analyzed for Trp‐cage miniprotein in water to elucidate the solvation effect in heat denaturation. The solvation free energy was computed for a set of protein structures at room and high temperatures with all‐atom molecular dynamics simulation combined with the solution theory in the...

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Publicat a:Protein Sci
Autors principals: Kamo, Fumitaka, Ishizuka, Ryosuke, Matubayasi, Nobuyuki
Format: Artigo
Idioma:Inglês
Publicat: John Wiley and Sons Inc. 2015
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Accés en línia:https://ncbi.nlm.nih.gov/pmc/articles/PMC4815324/
https://ncbi.nlm.nih.gov/pubmed/26189564
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1002/pro.2754
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