Analysis of the free-energy surface of proteins from reversible folding simulations.

Computer generated trajectories can, in principle, reveal the folding pathways of a protein at atomic resolution and possibly suggest general and simple rules for predicting the folded structure of a given sequence. While such reversible folding trajectories can only be determined ab initio using al...

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Bibliographic Details
Main Authors: Lucy R Allen, Sergei V Krivov, Emanuele Paci
Format: Article
Language:English
Published: Public Library of Science (PLoS) 2009-07-01
Series:PLoS Computational Biology
Online Access:http://europepmc.org/articles/PMC2700257?pdf=render