Flexible Boundaries for Multiresolution Solvation: An Algorithm for Spatial Multiscaling in Molecular Dynamics Simulations
Szklarczyk, Oliwia M., Bieler, Noah S., Hünenberger, Philippe H., van Gunsteren, Wilfred F.Volume:
11
Language:
english
Journal:
Journal of Chemical Theory and Computation
DOI:
10.1021/acs.jctc.5b00406
Date:
November, 2015
File:
PDF, 5.22 MB
english, 2015