Clusterappl and GPAW modules on Vera

.modules.kuba/clusterappl.lua

@@ -0,0 +1,20 @@
+whatis([==[
+Creates $USERAPPL environment variable and adds paths
+]==])
+
+local home      = os.getenv("HOME")
+local nobackup  = pathJoin(home, "nobackup")
+local userappl  = pathJoin(nobackup, "appl")
+local git       = pathJoin(nobackup, "git")
+
+local pythonp   = pathJoin(userappl, "lib/python3.7/site-packages")
+local binp      = pathJoin(userappl, "bin")
+local libp      = pathJoin(userappl, "lib")
+
+setenv("MYNOBACKUP", nobackup)
+setenv("USERAPPL", userappl)
+
+prepend_path("PYTHONPATH", pythonp)
+prepend_path("PATH", binp)
+prepend_path("PATH", libp)
+execute {cmd='`snakemake --bash-completion`', modeA={"load"}}