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Efficient Conformational Sampling in Explicit Solvent Using a Hybrid Replica Exchange Molecular Dynamics Method
Chaudhury, Sidhartha, Olson, Mark A., Tawa, Gregory, Wallqvist, Anders, Lee, Michael S.Volume:
8
Language:
english
Journal:
Journal of Chemical Theory and Computation
DOI:
10.1021/ct200529b
Date:
February, 2012
File:
PDF, 2.89 MB
english, 2012