GaussQ 1.0

19 07 2008

version 1.0
freeware
release May 30, 2008
by: TRN, LCAC, KASETSART UNIVERSITY, THAILAND


INSTALLATION
1. Extract file
$ tar -xf GaussQ1.0.tar
2. Change directory
$ cd GaussQ1.0
3. Install (DO NOT USE sudo !!! but insert password while install progress, if needed)
$ ./install
($chmod 777 install) <– do it if you can’t run install file
If you see 15 OKs, the installation is completed.

INSTRUCTIONS
$ subq FILE.com :Submit job to run or to be queued
$ showq :Show a running job, queued jobs, terminated jobs, and deleted jobs
$ delq FILE.com :D elete a running job or a queued job
$ hisq :Show history or clear history
$ hisq -clear :Clear history
$ logq FILE.com :Show log file

UNINSTALLATION
1. Change directory (USER=$whoami)
$ cd /home/USER/gaussq1.0
2. uninstall (DO NOT USE sudo !!! but insert password while uninstall progress, if needed)
$ ./uninstall
If you see 9 OKs, the uninstallation is completed.

RELEASE NOTES
1.0
-Compatible with Gaussian 03 in Personal computer
-Only one job running, others are queued

COPYRIGHT
As you see, this program files are not binary at all.
You can edit, copy, forward, develop or whatever you want.
But if it has some bugs, edit it by yourself and/or please let me know.

DOWNLOAD

GaussQ1.0 for Ubuntu

GaussQ1.0 for SuSE

GAUSSQ 1.1 project
-an update command
-fix bug about .rwf files when queue is deleted
-showq about deleted queues
-logq about scan Erem, … all job type


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One response

25 06 2009
Leekaash

I’m looking for a contact in the Chemistry department in Kasetsart University. Any Ph.D. student will be enough. I wonder if you could provide me a contact e-mail of somebody doing Ph.D, in Chemistry in Kasetsart University. Thanks

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