[gmx-users] segmentation fault : g_sas
Madhuri Agashe
magashe at CLEMSON.EDU
Sat Jan 31 01:15:01 CET 2004
Hi,
I am trying to analyze the solvent accessible areas for a protein after
running molecular dynamics on it.
I used the following command:
g_sas -f 2.trr -s 2.tpr -o area.xvg -r resarea.xvg -n 3.ndx
I always get the following output for this:
Opening library file /usr/local/share/gromacs/top/dgsolv.dat
++++++++ PLEASE CITE THE FOLLOWING REFERENCE ++++++++
D. Eisenberg and A. D. McLachlan
Solvation energy in protein folding and binding
Nature 319 (1986) pp. 199-203
-------- -------- --- Thank You --- -------- --------
3987 out of 70695 atoms were classified as hydrophobic
Back Off! I just backed up area.xvg to ./#area.xvg.3#
frame: 0Segmentation fault
Is this segmentation fault due to some error in any of the input files? Or
is there some problem with this command?
Thanks,
Madhuri
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