Difference between revisions of "JUSTUS2/Software"
< JUSTUS2
K Siegmund (talk | contribs) (→Documentation in the Wiki) |
K Siegmund (talk | contribs) (→Documentation in the Wiki) |
||
| Line 24: | Line 24: | ||
| − | * [[ |
+ | * [[ADF]] |
* [[JUSTUS2/Software/Dalton|Dalton]] |
* [[JUSTUS2/Software/Dalton|Dalton]] |
||
| − | * [[ |
+ | * [[Gaussian]] |
| − | * [[ |
+ | * [[Gaussview]] |
| − | * [[ |
+ | * [[Molden]] |
* [[JUSTUS2/Software/Schrodinger|Schrodinger]] |
* [[JUSTUS2/Software/Schrodinger|Schrodinger]] |
||
Revision as of 16:26, 14 July 2022
1 Environment Modules
Most software is provided as Modules.
Required reading to use: Environment Modules
2 Available Software
Visit https://www.bwhpc.de/software.php, select Cluster → bwForCluster JUSTUS2
On cluster: module avail
3 Documentation
Documentation by the cluster operators:
module help |
See section: Environment_Modules#module_help |
examples in $SOFTNAME_EXA_DIR |
See section: Environment_Modules#Software_job_examples |
| this wiki | See below |
4 Documentation in the Wiki
Modules with additional documentation here in the wiki:
