[gmx-users] Adding FE2+ or FE3+ into the system

liming_52 liming_52 at 163.com
Tue Jan 10 16:53:55 CET 2017

Dear gromacs users,

I want to compare the protein in the buffers with FE2+ and FE3+, respectively. 

How can I add FE2+ or FE3+ into the system? What is the command?

Thanks in advance.


With my best wishes,
Ming Li, PhD
Chinese Academy of Agricultural Sciences, Beijing, China

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