Mapping the Protein Fold Universe Using the CamTube Force Field in Molecular Dynamics Simulations

It has been recently shown that the coarse-graining of the structures of polypeptide chains as self-avoiding tubes can provide an effective representation of the conformational space of proteins. In order to fully exploit the opportunities offered by such a ‘tube model’ approach, we present here a s...

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Bibliographic Details
Main Authors: Kukic, Predrag, Kannan, Arvind, Dijkstra, Maurits J. J., Abeln, Sanne, Camilloni, Carlo, Vendruscolo, Michele
Format: Online
Language:English
Published: Public Library of Science 2015
Online Access:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4624779/