[gmx-users] how to do neutralization?

Seera Suryanarayana palusoori at gmail.com
Thu Nov 2 10:02:22 CET 2017


Dear gromacs users

I got the system non-zero total charge: -0.226000. When I add one NA ion to
the system I got non-zero total charge: +0.77. What is the way to
neutralize the system?

Thanks in advance
Surya
Graduate student
India.


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