Efficacy of independence sampling in replica exchange simulations of ordered and disordered proteins
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DOI: 10.1002/jcc.24923
Abstract: Recasting temperature replica exchange (T‐RE) as a special case of Gibbs sampling has led to a simple and efficient scheme for enhanced mixing (Chodera and Shirts, J. Chem. Phys., 2011, 135, 194110). To critically examine… read more here.
Keywords: independence sampling; replica exchange; simulations ordered; ordered disordered ... See more keywords