[gmx-users] top2psf.pl is generating some bonds to atoms with index 0.
Kwee Hong
jestan1985 at yahoo.com
Tue Oct 19 19:59:27 CEST 2010
Hi,
I've got a top2psf.pl script from the web and used it to generate a psf file.
Yet it generated some bonds to atoms with index 0 which should not occur. It
causes VMD cannot load it and had a segmentation fault.
vmd > Info) Using plugin psf for structure file /home/birg/Desktop/zz.psf
ERROR) Error reading bond information.
Segmentation fault
I wonder am I getting the right top2psf.pl. Or is there any place I can get the
latest stable version of that script?
Here, I attached the perl script I used.
Thanks.
Regards,
Joyce
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