[gmx-users] not integer charge

sara azhari sara_15_s at yahoo.com
Tue Jan 8 09:00:04 CET 2013

 Hi all,

I have not integer charge in my system (-0.11). I want to neutralize this charge by adding Na+. but I don't know how do this. I have an amino acid only in a box . adding one Na+ is wrong. because in pr step, system gives error and wrote odb file for each step. please guide me. 


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