High resolution ensemble description of metamorphic and intrinsically disordered proteins using an efficient hybrid parallel tempering scheme
R. Appadurai, J. Nagesh, A. Srivastava
The paper introduces an efficient hybrid parallel tempering method to accurately sample conformational ensembles of metamorphic and intrinsically disordered proteins, matching experimental data without reweighting.
Nature Communications · Feb 11, 2021Peer-reviewedBiophysics