[gmx-developers] head mdrun broken?

hess at sbc.su.se hess at sbc.su.se
Mon Dec 21 16:17:31 CET 2009


This is exactly the problem I mailed Michael Shirts about a few days ago.
I think he placed back the xi i/o line, but with double iso real.
You can fix it, or wait till Michael fixes it.


> Hi,
> there seems to be a problem with the current head version;
> I get a segmentation fault when I read in a tpr file. It happens
> at tpxio.c line 1978, ndo_double(state->nosehoover_xi ...
> Maybe this is already dealt with.
> Carsten
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