On 5/27/13 7:17 AM, DavidPO wrote:
I am sending you a .tpr file
topol.tpr <http://gromacs.5086.x6.nabble.com/file/n5008556/topol.tpr>
Thanks. I can reproduce the problem. I'll do a little digging and probably
open a bug report. Compilation proceeds without any issue, though it appears to
result in a nonfunctional QM-enabled mdrun executable. That definitely smells
buggy to me.
-Justin
--
========================================
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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