Folding Very Short Peptides Using Molecular Dynamics

Peptides often have conformational preferences. We simulated 133 peptide 8-mer fragments from six different proteins, sampled by replica-exchange molecular dynamics using Amber7 with a GB/SA (generalized-Born/solvent-accessible electrostatic approximation to water) implicit solvent. We found that 85...

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Detalles Bibliográficos
Autores principales: Ho, Bosco K, Dill, Ken A
Formato: Texto
Lenguaje:English
Publicado: Public Library of Science 2006
Materias:
Research Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC1435986/
https://www.ncbi.nlm.nih.gov/pubmed/16617376
http://dx.doi.org/10.1371/journal.pcbi.0020027

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC1435986/
https://www.ncbi.nlm.nih.gov/pubmed/16617376
http://dx.doi.org/10.1371/journal.pcbi.0020027

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