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Energy landscape of a peptide consisting of α-helix, 3(10)-helix, β-turn, β-hairpin, and other disordered conformations

The energy landscape of a peptide [Ace-Lys-Gln-Cys-Arg-Glu-Arg-Ala-Nme] in explicit water was studied with a multicanonical molecular dynamics simulation, and the AMBER parm96 force field was used for the energy calculation. The peptide was taken from the recognition helix of the DNA-binding protein...

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Autores principales: Higo, Junichi, Ito, Nobutoshi, Kuroda, Masataka, Ono, Satoshi, Nakajima, Nobuyuki, Nakamura, Haruki
Formato: Artigo
Lenguaje:Inglês
Publicado: Cold Spring Harbor Laboratory Press 2001
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Acceso en línea:https://ncbi.nlm.nih.gov/pmc/articles/PMC2374007/
https://ncbi.nlm.nih.gov/pubmed/11369854
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