[gmx-users] How to turn off charge groups

Jianwei Wang jwwang at ucdavis.edu
Fri Jun 2 20:13:39 CEST 2006


we use PME and our results (energy terms) seem depend on the charge group
assignment. Based on the manual, the results should not have anything to do
with charge groups. How can we turn off the charge groups. 

Jianwei



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