Validating clustering of molecular dynamics simulations using polymer models

<p>Abstract</p> <p>Background</p> <p>Molecular dynamics (MD) simulation is a powerful technique for sampling the meta-stable and transitional conformations of proteins and other biomolecules. Computational data clustering has emerged as a useful, automated technique for...

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Bibliographic Details
Main Authors: Phillips Joshua L, Colvin Michael E, Newsam Shawn
Format: Article
Language:English
Published: BMC 2011-11-01
Series:BMC Bioinformatics
Online Access:http://www.biomedcentral.com/1471-2105/12/445