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Improving the Efficiency of Configurational-Bias Monte Carlo: A Jacobian–Gaussian Scheme for Generating Bending Angle Trials for Linear and Branched Molecules
Sepehri, Aliasghar, Loeffler, Troy D., Chen, BinVolume:
13
Language:
english
Journal:
Journal of Chemical Theory and Computation
DOI:
10.1021/acs.jctc.7b00173
Date:
April, 2017
File:
PDF, 750 KB
english, 2017