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--- services:cluster:important [2025/02/07 15:26] – [SSH access] fix typo behrmj87
+++ services:cluster:important [2025/02/07 16:43] (current) – Add note on modules behrmj87
@@ Line 49: / Line 49: @@
 Assuming a key file ''id_sheldon''. You will need to change ''username'' to your username and ''headnode'' to the name of the head node (login node) of the cluster.
+==== Modules ====
+Modules are a staple in the HPC world. They are a way to change your environment to include paths that are not normally in your binary (~PATH~) or library search paths (~LD_LIBRARY_PATH~) so that you can use a wider variety/other/different versions of programs
+<code>
+These are the most important commands
+#+BEGIN_SRC bash
+# show available modules
+module avail
+# load a module
+module load name_of_module
+# e.g. module load gromacs/double/2020.4
+#
+# unload a module (usually not necessary in a job script, but you can use
+# modules interactively, too)
+module unload name_of_module
+</code>
+Somebody has to build the software. This is done by us and interested users, e.g. the GROMACS packages are mostly built by users in AG Netz. The software modules can be found in ~/net/opt~. If you want to contribute, let us know!