[gmx-users] Re: QM/MM simulations

Justin Lemkul jalemkul at vt.edu
Tue May 28 16:03:46 CEST 2013

On 5/28/13 6:03 AM, DavidPO wrote:
> Thank you.
> Can you tell me whether there was such a problem in earlier versions?
> If not, I could use for example version 4.5.7. Because I think it isn't very
> important at first stage of experiment.

I have no idea.  Try 4.5.7 and see.  If it does work in 4.5.7, please let us know.



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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