[gmx-users] Re: QM/MM simulations

[Justin Lemkul]

On 5/20/13 10:19 AM, DavidPO wrote:
>
> I send you "output.txt". These is the information that the program produces
> in terminal
> I also send you the "CMakeCache.txt" file as you request.
> Please check them out.
>
> David CMakeCache.txt
> <http://gromacs.5086.x6.nabble.com/file/n5008399/CMakeCache.txt>
> output.txt <http://gromacs.5086.x6.nabble.com/file/n5008399/output.txt>
>

Can you send me a .tpr file (off-list) to test?

-Justin

-- 
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Justin A. Lemkul, Ph.D.
Research Scientist
Department of Biochemistry
Virginia Tech
Blacksburg, VA
jalemkul[at]vt.edu | (540) 231-9080
http://www.bevanlab.biochem.vt.edu/Pages/Personal/justin

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