new file: c/CP2K/CP2K-9.1-fosscuda-2020b.eb

new file:   i/iCommands/iCommands-4.3.0.eb
	new file:   i/irodsfs/irodsfs-0.7.6.eb
	deleted:    c/CP2K/CP2K-2022.1-foss-2021a-CUDA-11.4.1.eb
	deleted:    c/CP2K/CP2K-2022.1-fosscuda-2020b.eb
	deleted:    i/iRODS/iRODS-0.7.6.eb

c/CP2K/CP2K-2022.1-foss-2021a-CUDA-11.4.1.eb

@@ -1,42 +0,0 @@
-# IT4Innovations 2022
-# JK
-# uses special easyblock for CUDA support!
-
-name = 'CP2K'
-version = '2022.1'
-versionsuffix = '-CUDA-%(cudaver)s'
-
-homepage = 'https://www.cp2k.org/'
-description = """CP2K is a freely available (GPL) program, written in Fortran 95, to perform atomistic and molecular
- simulations of solid state, liquid, molecular and biological systems. It provides a general framework for different
- methods such as e.g. density functional theory (DFT) using a mixed Gaussian and plane waves approach (GPW), and
- classical pair and many-body potentials. """
-
-toolchain = {'name': 'foss', 'version': '2021a'}
-toolchainopts = {'pic': True, 'openmp': True}
-
-source_urls = ['https://github.com/cp2k/cp2k/releases/download/v%(version)s/']
-sources = [SOURCELOWER_TAR_BZ2]
-checksums = ['2c34f1a7972973c62d471cd35856f444f11ab22f2ff930f6ead20f3454fd228b']
-
-dependencies = [
-    ('CUDA', '11.4.1', '', True),
-    ('Libint', '2.6.0', '-lmax-6-cp2k'),
-    ('libxc', '5.1.5'),
-    ('libxsmm', '1.16.2'),
-    ('FFTW', '3.3.9'),
-    ('PLUMED', '2.7.2'),
-]
-
-builddependencies = [
-    ('flex', '2.6.4'),
-    ('Bison', '3.7.6'),
-]
-
-type = 'psmp'
-
-# regression test reports handful of failures,
-# we're assuming those are OK to ignore...
-ignore_regtest_fails = True
-
-moduleclass = 'chem'

c/CP2K/CP2K-9.1-fosscuda-2020b.eb

@@ -1,5 +1,6 @@
 # IT4Innovations 2022
 # LK JK
+# --include-easyblocks /apps/easybuild/it4i-easyblocks/easyblocks/c/cp2k.py !!!
 
 name = 'CP2K'
 version = '8.2'

i/iCommands/iCommands-4.3.0.eb

@@ -0,0 +1,31 @@
+# Note:
+# This is an easyconfig file for EasyBuild, see https://github.com/easybuilders/easybuild
+# It was auto-generated based on a template easyconfig, so it should be used with care.
+easyblock = 'ConfigureMake'
+
+name = 'NAME'
+version = 'VERSION'
+
+homepage = 'http://www.example.com'
+description = """TEMPLATE DESCRIPTION"""
+
+# toolchain name should be 'TEMPLATE' if this is a template, so EasyBuild knows and is willing to use it as a template
+toolchain = {'name': 'TEMPLATE', 'version': 'TK_VERSION'}
+toolchainopts = {}  # toolchain options, e.g. opt, pic, usempi, optarch, ...
+
+# For sources line to work correctly with --try-software-version, you MUST employ %s OR use a construct like SOURCE_TAR_GZ
+sources = ['%(name)s-%(version)s.tar.gz']
+source_urls = ['http://www.example.com']
+
+patches = []
+
+dependencies = []
+
+# The sanity test MUST be tuned before going production and submitting your contribution to upstream git repositories
+sanity_check_paths = {
+    'files': [],
+    'dirs': ["."]
+}
+
+# You SHOULD change the following line; Kindly consult other easyconfigs for possible options
+moduleclass = 'base'

i/irodsfs/irodsfs-0.7.6.eb

@@ -3,7 +3,7 @@
 
 easyblock = 'PackedBinary'
 
-name = 'iRODS'
+name = 'irodsfs'
 version = '0.7.6'
 
 homepage = 'https://github.com/cyverse/irodsfs/'
@@ -24,6 +24,7 @@ postinstallcmds = [
     'cp /mnt/proj3/easybuild/scripts/irods-startup.sh %(installdir)s/',
     'curl -L https://docs.it4i.cz/irods1.it4i.cz.crt -o %(installdir)s/irods1.it4i.cz.crt',
 ]
-modluafooter = 'execute{cmd="bash $EBROOTIRODS/irods-startup.sh", modeA={"load"}}'
+
+modluafooter = 'execute{cmd="bash $EBROOTIRODSFS/irods-startup.sh", modeA={"load"}}'
 
 moduleclass = 'tools'