Hi!
I'm trying to run g_tune_pme on a case with verlet lists, but i get
complaints from mdrun that
"With Verlet lists rcoulomb and rvdw should be identical"
even with -scalevdw.
Using 4.6.5
g_tune_pme -r 3 -min 0.1 -rmin 0.7 -rmax 1.1 -scalevdw -ntpr 10 -s case.tpr
Is this a known problem or am i doing something wrong?
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Ake Sandgren, HPC2N, Umea University, S-90187 Umea, Sweden
Internet: a...@hpc2n.umu.se Phone: +46 90 7866134 Fax: +46 90-580 14
Mobile: +46 70 7716134 WWW: http://www.hpc2n.umu.se
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