[gmx-users] how to add sodium acetate

Justin Lemkul jalemkul at vt.edu
Tue Jun 4 17:18:24 CEST 2013

On 6/4/13 10:05 AM, maggin wrote:
> Hi, when we add Nacl, can use -pname NA -nname cl in GMX
> so for sodium acetate, how to display it ?

Use genbox -ci -nmol to add the acetate molecules, then genion to add Na+ ions.



Justin A. Lemkul, Ph.D.
Research Scientist
Department of Biochemistry
Virginia Tech
Blacksburg, VA
jalemkul[at]vt.edu | (540) 231-9080


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