Conformational sampling for the impatient

descriptionPublicationkeyboard_double_arrow_right Article 01 Feb 2004 English Publisher:Elsevier BVJournal:Biophysical Chemistry, volume 107, pages 213-220 (issn: 0301-4622,

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Authors: Kaihsu, Tai;

doi: 10.1016/j.bpc.2003.09.010

pmid: 14967236

Conformational sampling for the impatient

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Abstract

Several new methods for sampling conformations of biomolecules have appeared recently. A brief review thereof is presented, with particular emphasis on applications that have been published, and suitability for different kinds of systems. Four methods (namely: RESPA, replica-exchange molecular dynamics, CONCOORD and Gaussian network method) are readily applicable for biomolecular systems.

Related Organizations

University of Oxford
United Kingdom

Keywords

Models, Molecular, Protein Conformation, Animals, Humans, Proteins, Computer Simulation, Algorithms

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