[gmx-users] Metalloenzyme MD

Reza Esmaeili goldeagle.93 at gmail.com
Tue Jan 31 07:55:16 CET 2017

I’m trying to simulate a metalloenzyme containing an Fe2+.
What is the best way to make the Fe2+ stay in its place and not scape the position?
(Freezing the coordinates in not an option)

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