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REMC to study the thermodynamics of folding

Posted by dsingh on 27 Jun 2007 at 16:31 GMT

In all, these studies establish the extent of thermodynamic and structural pre-organization of folding of this model globular protein, and achieve the calculation of macromolecular stability ab initio, as required for ab initio structure prediction, genome annotation, and drug design.

Uses replica exchange techniques to look at protein folding thermodynamics and cooperative interactions