Structured pathway across the transition state for peptide folding revealed by molecular dynamics simulations.

Small globular proteins and peptides commonly exhibit two-state folding kinetics in which the rate limiting step of folding is the surmounting of a single free energy barrier at the transition state (TS) separating the folded and the unfolded states. An intriguing question is whether the polypeptide...

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Bibliographic Details
Main Authors: Lipi Thukral, Isabella Daidone, Jeremy C Smith
Format: Article
Language:English
Published: Public Library of Science (PLoS) 2011-09-01
Series:PLoS Computational Biology
Online Access:http://europepmc.org/articles/PMC3169518?pdf=render