[gmx-users] bug in gromacs-3.2.0beta1 grompp

Malcolm Gillies malcolm.b.gillies at anu.edu.au
Wed Jan 7 07:06:01 CET 2004


I've found what looks like a bug in grompp from gromacs-3.2.0beta1

grompp segfaults at line 555 of grompp.c when I define a position

It looks like the 'forward' array is used without checking first if it
is defined (not the case if shuffling is not used).


Malcolm Gillies <Malcolm.B.Gillies at anu.edu.au>
Postdoctoral Fellow, Computational Proteomics and Therapy Design Group,
John Curtin School of Medical Research, Australian National University

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