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The impact of interchain hydrogen bonding on β‐hairpin stability is readily predicted by molecular dynamics simulation

Peptides are frequently used model systems for protein folding. They are also gaining increased importance as therapeutics. Here, the ability of molecular dynamics (MD) simulation for describing the structure and dynamics of β‐hairpin peptides was investigated, with special attention given to the im...

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Detalles Bibliográficos
Autores principales: Niebling, Stephan, Danelius, Emma, Brath, Ulrika, Westenhoff, Sebastian, Erdélyi, Máté
Formato: Online Artículo Texto
Lenguaje:English
Publicado: John Wiley and Sons Inc. 2015
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4744756/
https://www.ncbi.nlm.nih.gov/pubmed/25968880
http://dx.doi.org/10.1002/bip.22671

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