Thomas,
I tried running your script on the current development version
and on a version 0.90 binary, and wasn't able to get PyMOL to crash.
How is PyMOL installed on your system?
Cheers,
Warren
--
mailto:war...@delanoscientific.com
Warren L. DeLano, Ph.D.
Principal Scientist
DeLano Scientific LLC
Voice (650)-346-1154
Fax (650)-593-4020
-Original Message-
From: pymol-users-ad...@lists.sourceforge.net [mailto:pymol-users-
ad...@lists.sourceforge.net] On Behalf Of Thomas Siegmund
Sent: Wednesday, September 10, 2003 6:16 AM
To: pymol-users@lists.sourceforge.net
Subject: [PyMOL] pymol raytracing crash
Hi everybody,
I am new to pymol. So maybe I'm doing something wrong, but pymol
almost
everytime crashes when I try to raytrace a picture. I had some success
with
small protein structures in cartoon representation. The same molecule
in
lines or sticks representation crashes the pymol raytracer.
Here some console output:
siegm...@siegmund:~ /usr/local/bin/python
/usr/local/lib/python2.3/site-packages/pymol/__init__.py -x
/tmp/pymol/7LYZ.pdb
PyMOL(TM) Molecular Graphics System, Version 0.90.
Copyright (C) 1998-2003 by DeLano Scientific LLC.
// I cut some lines here
OpenGL based graphics front end:
GL_VENDOR: NVIDIA Corporation
GL_RENDERER: RIVA TNT2/AGP/SSE2
GL_VERSION: 1.4.0 NVIDIA 44.96
PDBStrToCoordSet: Attempting to read symmetry information
Crystal: Unit Cell 27.400 31.900 34.400
Crystal: Alpha Beta Gamma88.000 108.000 112.000
Crystal: RealToFrac Matrix
Crystal:0.03650.01470.0133
Crystal:0.0.03380.0031
Crystal:0.0.0.0307
Crystal: FracToReal Matrix
Crystal: 27.4000 -11.9500 -10.6302
Crystal:0. 29.5772 -3.
Crystal:0.0. 32.5785
Crystal: Unit Cell Volume26402.
Symmetry: 1.0 0.0 0.0 0.0
Symmetry: 0.0 1.0 0.0 0.0
Symmetry: 0.0 0.0 1.0 0.0
Symmetry: 0.0 0.0 0.0 1.0
Executive: object 7LYZ created.
PyMOLutil.ss
util.ss: WARNING: This is not a correct secondary structure
// I cut some lines here
util.ss: assignment complete.
PyMOLhide lines
PyMOLshow cartoon
PyMOLray
Ray: total time: 1.14 sec. = 3145.7 frames/hour. (1.15 sec. accum.)
PyMOLhide cartoon
PyMOLshow sticks
PyMOLray
Speicherzugriffsfehler (segmentation fault)
Pymol is version 0.9, installed from source package on SuSE linux 8.2.
To
make
sure that it is not a problem of the python installation (standard
SuSE
8.2
rpm, python-2.2.2) I installed python 2.3 from source. Same result. In
the
mailing list archive I found comments about memory usage for
raytracing.
This
machine has 500 MB RAM. Top shows about 150-200 MB free RAM and 1GB
untouched
swap just before the raytracing. I tried the command set hash_max,
60 as
recommended, but this also did not help.
Any hints?
Tanks for your help
Thomas
--
Thomas Siegmund, Ph.D.
DeveloGen AG
Bioinformatics and Data Management
Phone: +49(551) 505 58 651
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