[gmx-users] genion problem

Golnaz Roudsari golnaz.chem at gmail.com
Mon Oct 5 08:26:59 CEST 2015


Dear all
I want to use bromide for neutralize my system. I wrote genion -s ions.tpr
-c file.gro -p topol.top -pname K -nname BR -nn 24. After I cheked it the
gromacs read Boron intead of bromide. I wrote command -nname BR -nn 24. and
I did not use K but in all cases my output was boron and I did not see any
Bromide.
I would appreciate any suggestion.


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