[gmx-developers] Possible bug with particle decomposition
Ondrej Marsalek
ondrej.marsalek at gmail.com
Thu Dec 16 15:05:45 CET 2010
Dear developers,
I got a colleague's simulations for debugging and it fails when I try
to run it with -pd. It does run with -dd 2 2 2 or with -nt 1. The end
of the output is:
starting mdrun 'methyl Chloride ice'
100000 steps, 100.0 ps.
tMPI error: Invalid buffer (null pointer in send or receive buffer)
(in valid comm)
tMPI error: Invalid buffer (null pointer in send or receive buffer)
(in valid comm)
Aborted
The tpr can be found here:
http://marge.uochb.cas.cz/~marsalek/tmp/topol.tpr
Thanks for having a look at this,
Ondrej
More information about the gromacs.org_gmx-developers
mailing list