Conformational populations of ligand-sized molecules by replica exchange molecular dynamics and temperature reweighting
Author:
Publisher
Wiley
Subject
Computational Mathematics,General Chemistry
Link
http://onlinelibrary.wiley.com/wol1/doi/10.1002/jcc.21419/fullpdf
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1. Exchange Monte Carlo Method and Application to Spin Glass Simulations
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4. Generalized ensemble simulations for complex systems
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