All public logs
Jump to navigation Jump to search
Combined display of all available logs of TheoChem Cluster. You can narrow down the view by selecting a log type, the username (case-sensitive), or the affected page (also case-sensitive).
- 13:29, 27 March 2019 Sami created page Basics (Created page with "=Submitting a job= <br> The queuing system on TheoChem is SLURM and it works similar to [https://redmine.hpc.rug.nl/redmine/projects/peregrine/wiki peregrine].<br> * [https://...")
- 13:25, 27 March 2019 Sami created page Software (Created page with "=Available Software= * Gamess-uk * Gromacs * GronOR * IQmol * MCTDH * Molden * ORCA * QChem * Quantics * VMD <br>")
- 13:23, 27 March 2019 Sami created page MediaWiki:Sidebar (Created page with "* navigation ** mainpage|mainpage ** Special:RecentChanges|Recent changes * new heading ** portal-url|portal ** http://www.mediawiki.org|MediaWiki home")
- 13:12, 27 March 2019 Sami created page VMD (Created page with "VMD is a visualization software often used for Molecular Dynamics. Load the module with: module load vmd Then start the program with: vmd For more information, check the...")
- 07:16, 26 March 2019 Sami created page Gromacs (Created page with " A sample job script for GROMACS looks like this: #!/bin/bash #SBATCH --time=3-00:00:00 #SBATCH --nodes=1 #SBATCH --ntasks-per-node=36 #SBATCH -o relax.out module pur...")