modified: g/GROMACS/GROMACS-2022-fosscuda-2020b.eb

new file: g/GROMACS/GROMACS-iostream.patch new file: h/hwloc/hwloc-2.8.0-GCCcore-12.2.0.eb new file: h/hwloc/hwloc-2.8.0-GCCcore-12.3.0.eb modified: i/iimpi/iimpi-2020a.eb new file: i/iimpi/iimpi-2020b.eb new file: i/iimpi/iimpi-2021a.eb new file: i/iimpi/iimpi-2021b.eb new file: i/iimpi/iimpi-2022a.eb new file: i/iimpi/iimpi-2022b.eb new file: i/iimpi/iimpi-2023a.eb new file: i/impi/impi-2021.4.0-intel-compilers-2022.1.0.eb new file: i/impi/impi-2021.4.0-intel-compilers-2022.2.1.eb new file: i/impi/impi-2021.4.0-intel-compilers-2023.1.0.eb new file: i/impi/impi-2021.9.0-intel-compilers-2023.1.0-test.eb new file: i/impi/impi-2021.9.0-intel-compilers-2023.1.0.eb new file: i/intel/intel-2020.00.eb new file: i/intel/intel-2020.06-impi-18.5.eb new file: i/intel/intel-2020.12.eb modified: i/intel/intel-2020a.eb new file: i/intel/intel-2021a.eb new file: i/intel/intel-2021b.eb new file: i/intel/intel-2022a.eb new file: i/intel/intel-2022b.eb new file: i/intel/intel-2023a.eb new file: l/LAre3d/LAre3d-20230726-intel-2022b-v2.eb new file: l/libxml2/libxml2-2.10.3-GCCcore-12.2.0.eb new file: l/libxml2/libxml2-2.10.3-GCCcore-12.3.0.eb new file: n/networkx/networkx-2.5-fosscuda-2020b.eb modified: o/OpenMPI/OpenMPI-4.1.4-GCC-11.3.0.eb new file: o/OpenMPI/OpenMPI-4.1.5-GCC-12.2.0.eb modified: o/OpenMPI/OpenMPI-4.1.5-NVHPC-23.5-CUDA-12.2.0.eb new file: p/PMIx/PMIx-4.2.6-GCC-12.2.0.eb new file: p/PyTorch/PyTorch-1.10.0-fosscuda-2020b.eb new file: p/PyTorch/PyTorch-1.13.1-foss-2022b.eb new file: p/phonopy/phonopy-2.16.3-foss-2022a.eb new file: p/phonopy/phonopy-2.20.0-conda.eb new file: p/phonopy/phonopy-2.20.0-foss-2022a.eb new file: u/UCX/UCX-1.14.1-GCCcore-11.3.0.eb new file: u/UCX/UCX-1.14.1-GCCcore-12.3.0-test.eb new file: v/VisIt/VisIt-2.13.3.eb new file: x/XZ/XZ-5.2.7-GCCcore-12.2.0.eb new file: x/XZ/XZ-5.2.7-GCCcore-12.3.0.eb new file: z/zlib/zlib-1.2.12-GCCcore-12.2.0.eb new file: z/zlib/zlib-1.2.12-GCCcore-12.3.0.eb deleted: o/OpenMPI/OpenMPI-4.1.5-GCC-12.3.0.eb
2025-04-04 06:11:36 +01:00 · 2023-09-25 09:14:47 +02:00 · 2023-09-25 09:14:47 +02:00 · 54e9fa82d5
commit 54e9fa82d5
parent 09cf5bbb5c
45 changed files with 1435 additions and 25 deletions
--- a/g/GROMACS/GROMACS-2022-fosscuda-2020b.eb
+++ b/g/GROMACS/GROMACS-2022-fosscuda-2020b.eb
@ -36,6 +36,15 @@ patches = [
    'GROMACS-2019_increase_test_timeout_for_GPU.patch',
 #    'GROMACS-2021_fix_gmxapi_gmx_allowed_cmd_name.patch',
    'GROMACS-2021.5_fix_threads_gpu_Gmxapitests.patch',
+    'GROMACS-iostream.patch',
+]
+
+checksums = [
+    'fad60d606c02e6164018692c6c9f2c159a9130c2bf32e8c5f4f1b6ba2dda2b68',
+    '406f5edd204be812f095a6f07ebc2673c5f6ddf1b1c1428fd336a80b9c629275',
+    '0d16f53d428155197a0ed0b0974ce03422f199d7c463c4a9156a3b99e3c86234',
+    '7d39da0b431fbc9e94e857552246eb0ec892f26b13e519b3706785cc5e01a563',
+    '51f649e0aca86676d059eafc5427283c3f2d1702aa2711531ddc72398417c466'
 ]

 builddependencies = [
@ -45,7 +54,7 @@ builddependencies = [

 dependencies = [
    ('Python', '3.8.6'),
-    ('SciPy-bundle', '2020.11'),
+#    ('SciPy-bundle', '2020.11'),
    ('networkx', '2.5'),
 #    ('PLUMED', local_plum_ver),
 ]
--- a/g/GROMACS/GROMACS-iostream.patch
+++ b/g/GROMACS/GROMACS-iostream.patch
@ -0,0 +1,11 @@
+--- python_packaging/sample_restraint/src/pythonmodule/export_plugin.cpp.orig	2023-09-21 13:20:50.320657581 +0200
+++ python_packaging/sample_restraint/src/pythonmodule/export_plugin.cpp	2023-09-21 13:21:01.262549302 +0200
+@@ -9,7 +9,7 @@
+  */
+ 
+ #include "export_plugin.h"
+-
+#include <iostream>
+ #include <cassert>
+ 
+ #include <memory>
--- a/h/hwloc/hwloc-2.8.0-GCCcore-12.2.0.eb
+++ b/h/hwloc/hwloc-2.8.0-GCCcore-12.2.0.eb
@ -0,0 +1,45 @@
+easyblock = 'ConfigureMake'
+
+name = 'hwloc'
+version = '2.8.0'
+
+homepage = 'https://www.open-mpi.org/projects/hwloc/'
+
+description = """
+ The Portable Hardware Locality (hwloc) software package provides a portable
+ abstraction (across OS, versions, architectures, ...) of the hierarchical
+ topology of modern architectures, including NUMA memory nodes, sockets, shared
+ caches, cores and simultaneous multithreading. It also gathers various system
+ attributes such as cache and memory information as well as the locality of I/O
+ devices such as network interfaces, InfiniBand HCAs or GPUs. It primarily
+ aims at helping applications with gathering information about modern computing
+ hardware so as to exploit it accordingly and efficiently.
+"""
+
+toolchain = {'name': 'GCCcore', 'version': '12.2.0'}
+
+source_urls = ['https://www.open-mpi.org/software/hwloc/v%(version_major_minor)s/downloads/']
+sources = [SOURCE_TAR_GZ]
+checksums = ['20b2bd4df436827d8e50f7afeafb6f967259f2fb374ce7330244f8d0ed2dde6f']
+
+builddependencies = [
+    ('binutils', '2.39'),
+]
+
+dependencies = [
+    ('numactl', '2.0.16'),
+    ('libxml2', '2.10.3'),
+    ('libpciaccess', '0.17'),
+]
+
+configopts = "--enable-libnuma=$EBROOTNUMACTL "
+configopts += "--disable-cairo --disable-opencl --disable-cuda --disable-nvml --disable-gl --disable-libudev "
+
+sanity_check_paths = {
+    'files': ['bin/lstopo', 'include/hwloc/linux.h',
+              'lib/libhwloc.%s' % SHLIB_EXT],
+    'dirs': ['share/man/man3'],
+}
+sanity_check_commands = ['lstopo']
+
+moduleclass = 'system'
--- a/h/hwloc/hwloc-2.8.0-GCCcore-12.3.0.eb
+++ b/h/hwloc/hwloc-2.8.0-GCCcore-12.3.0.eb
@ -0,0 +1,48 @@
+# IT4Innovations
+# LK 2023
+
+easyblock = 'ConfigureMake'
+
+name = 'hwloc'
+version = '2.8.0'
+
+homepage = 'https://www.open-mpi.org/projects/hwloc/'
+
+description = """
+ The Portable Hardware Locality (hwloc) software package provides a portable
+ abstraction (across OS, versions, architectures, ...) of the hierarchical
+ topology of modern architectures, including NUMA memory nodes, sockets, shared
+ caches, cores and simultaneous multithreading. It also gathers various system
+ attributes such as cache and memory information as well as the locality of I/O
+ devices such as network interfaces, InfiniBand HCAs or GPUs. It primarily
+ aims at helping applications with gathering information about modern computing
+ hardware so as to exploit it accordingly and efficiently.
+"""
+
+toolchain = {'name': 'GCCcore', 'version': '12.3.0'}
+
+source_urls = ['https://www.open-mpi.org/software/hwloc/v%(version_major_minor)s/downloads/']
+sources = [SOURCE_TAR_GZ]
+checksums = ['20b2bd4df436827d8e50f7afeafb6f967259f2fb374ce7330244f8d0ed2dde6f']
+
+builddependencies = [
+    ('binutils', '2.40'),
+]
+
+dependencies = [
+    ('numactl', '2.0.16'),
+    ('libxml2', '2.10.3'),
+    ('libpciaccess', '0.17'),
+]
+
+configopts = "--enable-libnuma=$EBROOTNUMACTL "
+configopts += "--disable-cairo --disable-opencl --disable-cuda --disable-nvml --disable-gl --disable-libudev "
+
+sanity_check_paths = {
+    'files': ['bin/lstopo', 'include/hwloc/linux.h',
+              'lib/libhwloc.%s' % SHLIB_EXT],
+    'dirs': ['share/man/man3'],
+}
+sanity_check_commands = ['lstopo']
+
+moduleclass = 'system'
--- a/i/iimpi/iimpi-2020a.eb
+++ b/i/iimpi/iimpi-2020a.eb
@ -1,6 +1,4 @@
-# IT4Innovations 2021
-# LK
-
+# This is an easyconfig file for EasyBuild, see http://easybuilders.github.io/easybuild
 easyblock = 'Toolchain'

 name = 'iimpi'
@ -14,7 +12,7 @@ toolchain = SYSTEM
 local_compver = '2020.1.217'
 dependencies = [
    ('iccifort', local_compver),
-    ('impi', '2019.9.304', '', ('iccifort', local_compver)),
+    ('impi', '2019.7.217', '', ('iccifort', local_compver)),
 ]

 moduleclass = 'toolchain'
--- a/i/iimpi/iimpi-2020b.eb
+++ b/i/iimpi/iimpi-2020b.eb
@ -0,0 +1,18 @@
+# This is an easyconfig file for EasyBuild, see http://easybuilders.github.io/easybuild
+easyblock = 'Toolchain'
+
+name = 'iimpi'
+version = '2020b'
+
+homepage = 'https://software.intel.com/parallel-studio-xe'
+description = """Intel C/C++ and Fortran compilers, alongside Intel MPI."""
+
+toolchain = SYSTEM
+
+local_compver = '2020.4.304'
+dependencies = [
+    ('iccifort', local_compver),
+    ('impi', '2019.9.304', '', ('iccifort', local_compver)),
+]
+
+moduleclass = 'toolchain'
--- a/i/iimpi/iimpi-2021a.eb
+++ b/i/iimpi/iimpi-2021a.eb
@ -0,0 +1,18 @@
+# This is an easyconfig file for EasyBuild, see http://easybuilders.github.io/easybuild
+easyblock = 'Toolchain'
+
+name = 'iimpi'
+version = '2021a'
+
+homepage = 'https://software.intel.com/parallel-studio-xe'
+description = """Intel C/C++ and Fortran compilers, alongside Intel MPI."""
+
+toolchain = SYSTEM
+
+local_comp_ver = '2021.2.0'
+dependencies = [
+    ('intel-compilers', local_comp_ver),
+    ('impi', local_comp_ver, '', ('intel-compilers', local_comp_ver)),
+]
+
+moduleclass = 'toolchain'
--- a/i/iimpi/iimpi-2021b.eb
+++ b/i/iimpi/iimpi-2021b.eb
@ -0,0 +1,18 @@
+# This is an easyconfig file for EasyBuild, see http://easybuilders.github.io/easybuild
+easyblock = 'Toolchain'
+
+name = 'iimpi'
+version = '2021b'
+
+homepage = 'https://software.intel.com/parallel-studio-xe'
+description = """Intel C/C++ and Fortran compilers, alongside Intel MPI."""
+
+toolchain = SYSTEM
+
+local_comp_ver = '2021.4.0'
+dependencies = [
+    ('intel-compilers', local_comp_ver),
+    ('impi', local_comp_ver, '', ('intel-compilers', local_comp_ver)),
+]
+
+moduleclass = 'toolchain'
--- a/i/iimpi/iimpi-2022a.eb
+++ b/i/iimpi/iimpi-2022a.eb
@ -0,0 +1,20 @@
+# IT4Innovations
+# LK 2023
+
+easyblock = 'Toolchain'
+
+name = 'iimpi'
+version = '2022a'
+
+homepage = 'https://software.intel.com/parallel-studio-xe'
+description = """Intel C/C++ and Fortran compilers, alongside Intel MPI."""
+
+toolchain = SYSTEM
+
+local_comp_ver = '2022.1.0'
+dependencies = [
+    ('intel-compilers', local_comp_ver),
+    ('impi', '2021.4.0', '', ('intel-compilers', local_comp_ver)),
+]
+
+moduleclass = 'toolchain'
--- a/i/iimpi/iimpi-2022b.eb
+++ b/i/iimpi/iimpi-2022b.eb
@ -0,0 +1,20 @@
+# IT4Innovations
+# LK 2023
+
+easyblock = 'Toolchain'
+
+name = 'iimpi'
+version = '2022b'
+
+homepage = 'https://software.intel.com/parallel-studio-xe'
+description = """Intel C/C++ and Fortran compilers, alongside Intel MPI."""
+
+toolchain = SYSTEM
+
+local_comp_ver = '2022.2.1'
+dependencies = [
+    ('intel-compilers', local_comp_ver),
+    ('impi', '2021.4.0', '', ('intel-compilers', local_comp_ver)),
+]
+
+moduleclass = 'toolchain'
--- a/i/iimpi/iimpi-2023a.eb
+++ b/i/iimpi/iimpi-2023a.eb
@ -0,0 +1,20 @@
+# IT4Innovations
+# LK 2023
+
+easyblock = 'Toolchain'
+
+name = 'iimpi'
+version = '2023a'
+
+homepage = 'https://software.intel.com/parallel-studio-xe'
+description = """Intel C/C++ and Fortran compilers, alongside Intel MPI."""
+
+toolchain = SYSTEM
+
+local_comp_ver = '2023.1.0'
+dependencies = [
+    ('intel-compilers', local_comp_ver),
+    ('impi', '2021.4.0', '', ('intel-compilers', local_comp_ver)),
+]
+
+moduleclass = 'toolchain'
--- a/i/impi/impi-2021.4.0-intel-compilers-2022.1.0.eb
+++ b/i/impi/impi-2021.4.0-intel-compilers-2022.1.0.eb
@ -0,0 +1,38 @@
+# IT4Innovations 2022
+# LK JK
+
+name = 'impi'
+version = '2021.4.0'
+
+homepage = 'https://software.intel.com/content/www/us/en/develop/tools/mpi-library.html'
+description = "Intel MPI Library, compatible with MPICH ABI"
+
+toolchain = {'name': 'intel-compilers', 'version': '2022.1.0'}
+
+# see https://software.intel.com/content/www/us/en/develop/articles/oneapi-standalone-components.html
+source_urls = ['https://registrationcenter-download.intel.com/akdlm/irc_nas/18186/']
+sources = ['l_mpi_oneapi_p_%(version)s.441_offline.sh']
+checksums = ['cc4b7072c61d0bd02b1c431b22d2ea3b84b967b59d2e587e77a9e7b2c24f2a29']
+
+dependencies = [('UCX', '1.14.1')]
+
+accept_eula = True
+
+modextravars = {
+    "I_MPI_CC": "icc",
+    "I_MPI_CXX": "icpc",
+    "I_MPI_F77": "ifort",
+    "I_MPI_F90": "ifort",
+    "I_MPI_FC": "ifort",
+    "I_MPI_PMI_VALUE_LENGTH_MAX": "512",
+}
+
+modaliases = {
+    "mpigcc": "mpigcc -cc=gcc",
+    "mpigxx": "mpigxx -cxx=g++",
+    "mpiicc": "mpiicc -cc=icc",
+    "mpiicpc":"mpiicpc -cxx=icpc",
+    "mpiifort": "mpiifort -f90=ifort",
+}
+
+moduleclass = 'mpi'
--- a/i/impi/impi-2021.4.0-intel-compilers-2022.2.1.eb
+++ b/i/impi/impi-2021.4.0-intel-compilers-2022.2.1.eb
@ -0,0 +1,38 @@
+# IT4Innovations 2022
+# LK JK
+
+name = 'impi'
+version = '2021.4.0'
+
+homepage = 'https://software.intel.com/content/www/us/en/develop/tools/mpi-library.html'
+description = "Intel MPI Library, compatible with MPICH ABI"
+
+toolchain = {'name': 'intel-compilers', 'version': '2022.2.1'}
+
+# see https://software.intel.com/content/www/us/en/develop/articles/oneapi-standalone-components.html
+source_urls = ['https://registrationcenter-download.intel.com/akdlm/irc_nas/18186/']
+sources = ['l_mpi_oneapi_p_%(version)s.441_offline.sh']
+checksums = ['cc4b7072c61d0bd02b1c431b22d2ea3b84b967b59d2e587e77a9e7b2c24f2a29']
+
+dependencies = [('UCX', '1.14.1')]
+
+accept_eula = True
+
+modextravars = {
+    "I_MPI_CC": "icc",
+    "I_MPI_CXX": "icpc",
+    "I_MPI_F77": "ifort",
+    "I_MPI_F90": "ifort",
+    "I_MPI_FC": "ifort",
+    "I_MPI_PMI_VALUE_LENGTH_MAX": "512",
+}
+
+modaliases = {
+    "mpigcc": "mpigcc -cc=gcc",
+    "mpigxx": "mpigxx -cxx=g++",
+    "mpiicc": "mpiicc -cc=icc",
+    "mpiicpc":"mpiicpc -cxx=icpc",
+    "mpiifort": "mpiifort -f90=ifort",
+}
+
+moduleclass = 'mpi'
--- a/i/impi/impi-2021.4.0-intel-compilers-2023.1.0.eb
+++ b/i/impi/impi-2021.4.0-intel-compilers-2023.1.0.eb
@ -0,0 +1,38 @@
+# IT4Innovations 2022
+# LK JK
+
+name = 'impi'
+version = '2021.4.0'
+
+homepage = 'https://software.intel.com/content/www/us/en/develop/tools/mpi-library.html'
+description = "Intel MPI Library, compatible with MPICH ABI"
+
+toolchain = {'name': 'intel-compilers', 'version': '2023.1.0'}
+
+# see https://software.intel.com/content/www/us/en/develop/articles/oneapi-standalone-components.html
+source_urls = ['https://registrationcenter-download.intel.com/akdlm/irc_nas/18186/']
+sources = ['l_mpi_oneapi_p_%(version)s.441_offline.sh']
+checksums = ['cc4b7072c61d0bd02b1c431b22d2ea3b84b967b59d2e587e77a9e7b2c24f2a29']
+
+dependencies = [('UCX', '1.14.1')]
+
+accept_eula = True
+
+modextravars = {
+    "I_MPI_CC": "icc",
+    "I_MPI_CXX": "icpc",
+    "I_MPI_F77": "ifort",
+    "I_MPI_F90": "ifort",
+    "I_MPI_FC": "ifort",
+    "I_MPI_PMI_VALUE_LENGTH_MAX": "512",
+}
+
+modaliases = {
+    "mpigcc": "mpigcc -cc=gcc",
+    "mpigxx": "mpigxx -cxx=g++",
+    "mpiicc": "mpiicc -cc=icc",
+    "mpiicpc":"mpiicpc -cxx=icpc",
+    "mpiifort": "mpiifort -f90=ifort",
+}
+
+moduleclass = 'mpi'
--- a/i/impi/impi-2021.9.0-intel-compilers-2023.1.0-test.eb
+++ b/i/impi/impi-2021.9.0-intel-compilers-2023.1.0-test.eb
@ -0,0 +1,25 @@
+# IT4Innovations
+# LK 2023
+
+name = 'impi'
+version = '2021.9.0'
+versionsuffix = '-test'
+
+homepage = 'https://software.intel.com/content/www/us/en/develop/tools/mpi-library.html'
+description = "Intel MPI Library, compatible with MPICH ABI"
+
+toolchain = {'name': 'intel-compilers', 'version': '2023.1.0'}
+
+# see https://software.intel.com/content/www/us/en/develop/articles/oneapi-standalone-components.html
+source_urls = ['https://registrationcenter-download.intel.com/akdlm/IRC_NAS/718d6f8f-2546-4b36-b97b-bc58d5482ebf/']
+sources = ['l_mpi_oneapi_p_%(version)s.43482_offline.sh']
+checksums = ['5c170cdf26901311408809ced28498b630a494428703685203ceef6e62735ef8']
+
+dependencies = [('UCX', '1.14.1', '-test')]
+
+modextravars = {
+    'I_MPI_OFI_PROVIDER': 'MLX',
+    'FI_PROVIDER': 'mlx',
+}
+
+moduleclass = 'mpi'
--- a/i/impi/impi-2021.9.0-intel-compilers-2023.1.0.eb
+++ b/i/impi/impi-2021.9.0-intel-compilers-2023.1.0.eb
@ -0,0 +1,19 @@
+# IT4Innovations
+# LK 2023
+
+name = 'impi'
+version = '2021.9.0'
+
+homepage = 'https://software.intel.com/content/www/us/en/develop/tools/mpi-library.html'
+description = "Intel MPI Library, compatible with MPICH ABI"
+
+toolchain = {'name': 'intel-compilers', 'version': '2023.1.0'}
+
+# see https://software.intel.com/content/www/us/en/develop/articles/oneapi-standalone-components.html
+source_urls = ['https://registrationcenter-download.intel.com/akdlm/IRC_NAS/718d6f8f-2546-4b36-b97b-bc58d5482ebf/']
+sources = ['l_mpi_oneapi_p_%(version)s.43482_offline.sh']
+checksums = ['5c170cdf26901311408809ced28498b630a494428703685203ceef6e62735ef8']
+
+dependencies = [('UCX', '1.14.1')]
+
+moduleclass = 'mpi'
--- a/i/intel/intel-2020.00.eb
+++ b/i/intel/intel-2020.00.eb
@ -0,0 +1,22 @@
+easyblock = 'Toolchain'
+
+name = 'intel'
+version = '2020.00'
+
+homepage = 'https://easybuild.readthedocs.io/en/master/Common-toolchains.html#intel-toolchain'
+description = "Compiler toolchain including Intel compilers, Intel MPI and Intel Math Kernel Library (MKL)."
+
+toolchain = SYSTEM
+
+local_compver = '2020.0.166'
+local_gccver = '9.2.0'
+local_gccsuff = '-GCC-%s' % (local_gccver)
+dependencies = [
+    ('GCCcore', local_gccver),
+    ('binutils', '2.32', '', ('GCCcore', local_gccver)),
+    ('iccifort', local_compver, local_gccsuff),
+    ('impi', '2019.6.166', '', ('iccifort', '%s%s' % (local_compver, local_gccsuff))),
+    ('imkl', local_compver, '', ('iimpi', version)),
+]
+
+moduleclass = 'toolchain'
--- a/i/intel/intel-2020.06-impi-18.5.eb
+++ b/i/intel/intel-2020.06-impi-18.5.eb
@ -0,0 +1,21 @@
+easyblock = 'Toolchain'
+
+name = 'intel'
+version = '2020.06-impi-18.5'
+
+homepage = 'https://easybuild.readthedocs.io/en/master/Common-toolchains.html#intel-toolchain'
+description = "Compiler toolchain including Intel compilers, Intel MPI and Intel Math Kernel Library (MKL)."
+
+toolchain = SYSTEM
+
+local_compver = '2020.1.217'
+local_gccver = '9.3.0'
+dependencies = [
+    ('GCCcore', local_gccver),
+    ('binutils', '2.34', '', ('GCCcore', local_gccver)),
+    ('iccifort', local_compver),
+    ('impi', '2018.5.288', '', ('iccifort', local_compver)),
+    ('imkl', local_compver, '', ('iimpi', version)),
+]
+
+moduleclass = 'toolchain'
--- a/i/intel/intel-2020.12.eb
+++ b/i/intel/intel-2020.12.eb
@ -0,0 +1,21 @@
+easyblock = 'Toolchain'
+
+name = 'intel'
+version = '2020.12'
+
+homepage = 'https://easybuild.readthedocs.io/en/master/Common-toolchains.html#intel-toolchain'
+description = "Compiler toolchain including Intel compilers, Intel MPI and Intel Math Kernel Library (MKL)."
+
+toolchain = SYSTEM
+
+local_compver = '2021.1.2'
+local_gccver = '10.2.0'
+dependencies = [
+    ('GCCcore', local_gccver),
+    ('binutils', '2.35', '', ('GCCcore', local_gccver)),
+    ('intel-compilers', local_compver),
+    ('impi', '2021.1.1', '', ('intel-compilers', local_compver)),
+    ('imkl', '2021.1.1', '', ('iimpi', version)),
+]
+
+moduleclass = 'toolchain'
--- a/i/intel/intel-2020a.eb
+++ b/i/intel/intel-2020a.eb
@ -1,6 +1,3 @@
-# IT4Innovations
-# LK 2021
-
 easyblock = 'Toolchain'

 name = 'intel'
@ -17,7 +14,7 @@ dependencies = [
    ('GCCcore', local_gccver),
    ('binutils', '2.34', '', ('GCCcore', local_gccver)),
    ('iccifort', local_compver),
-    ('impi', '2019.9.304', '', ('iccifort', local_compver)),
+    ('impi', '2019.7.217', '', ('iccifort', local_compver)),
    ('imkl', local_compver, '', ('iimpi', version)),
 ]

--- a/i/intel/intel-2021a.eb
+++ b/i/intel/intel-2021a.eb
@ -0,0 +1,21 @@
+easyblock = 'Toolchain'
+
+name = 'intel'
+version = '2021a'
+
+homepage = 'https://easybuild.readthedocs.io/en/master/Common-toolchains.html#intel-toolchain'
+description = "Compiler toolchain including Intel compilers, Intel MPI and Intel Math Kernel Library (MKL)."
+
+toolchain = SYSTEM
+
+local_comp_ver = '2021.2.0'
+local_gccver = '10.3.0'
+dependencies = [
+    ('GCCcore', local_gccver),
+    ('binutils', '2.36.1', '', ('GCCcore', local_gccver)),
+    ('intel-compilers', local_comp_ver),
+    ('impi', local_comp_ver, '', ('intel-compilers', local_comp_ver)),
+    ('imkl', local_comp_ver, '', ('iimpi', version)),
+]
+
+moduleclass = 'toolchain'
--- a/i/intel/intel-2021b.eb
+++ b/i/intel/intel-2021b.eb
@ -0,0 +1,22 @@
+easyblock = 'Toolchain'
+
+name = 'intel'
+version = '2021b'
+
+homepage = 'https://easybuild.readthedocs.io/en/master/Common-toolchains.html#intel-toolchain'
+description = "Compiler toolchain including Intel compilers, Intel MPI and Intel Math Kernel Library (MKL)."
+
+toolchain = SYSTEM
+
+local_comp_ver = '2021.4.0'
+local_gccver = '11.2.0'
+dependencies = [
+    ('GCCcore', local_gccver),
+    ('binutils', '2.37', '', ('GCCcore', local_gccver)),
+    ('intel-compilers', local_comp_ver),
+    ('impi', local_comp_ver, '', ('intel-compilers', local_comp_ver)),
+    ('imkl', local_comp_ver, '', SYSTEM),
+    ('imkl-FFTW', local_comp_ver, '', ('iimpi', version)),
+]
+
+moduleclass = 'toolchain'
--- a/i/intel/intel-2022a.eb
+++ b/i/intel/intel-2022a.eb
@ -0,0 +1,25 @@
+# IT4Innovations
+# LK 2023
+
+easyblock = 'Toolchain'
+
+name = 'intel'
+version = '2022a'
+
+homepage = 'https://easybuild.readthedocs.io/en/master/Common-toolchains.html#intel-toolchain'
+description = "Compiler toolchain including Intel compilers, Intel MPI and Intel Math Kernel Library (MKL)."
+
+toolchain = SYSTEM
+
+local_comp_ver = '2022.1.0'
+local_gccver = '11.3.0'
+dependencies = [
+    ('GCCcore', local_gccver),
+    ('binutils', '2.38', '', ('GCCcore', local_gccver)),
+    ('intel-compilers', local_comp_ver),
+    ('impi', '2021.4.0', '', ('intel-compilers', local_comp_ver)),
+    ('imkl', local_comp_ver, '', SYSTEM),
+    ('imkl-FFTW', local_comp_ver, '', ('iimpi', version)),
+]
+
+moduleclass = 'toolchain'
--- a/i/intel/intel-2022b.eb
+++ b/i/intel/intel-2022b.eb
@ -0,0 +1,25 @@
+# IT4Innovations
+# LK 2023
+
+easyblock = 'Toolchain'
+
+name = 'intel'
+version = '2022b'
+
+homepage = 'https://easybuild.readthedocs.io/en/master/Common-toolchains.html#intel-toolchain'
+description = "Compiler toolchain including Intel compilers, Intel MPI and Intel Math Kernel Library (MKL)."
+
+toolchain = SYSTEM
+
+local_comp_ver = '2022.2.1'
+local_gccver = '12.2.0'
+dependencies = [
+    ('GCCcore', local_gccver),
+    ('binutils', '2.39', '', ('GCCcore', local_gccver)),
+    ('intel-compilers', local_comp_ver),
+    ('impi', '2021.4.0', '', ('intel-compilers', local_comp_ver)),
+    ('imkl', local_comp_ver, '', SYSTEM),
+    ('imkl-FFTW', local_comp_ver, '', ('iimpi', version)),
+]
+
+moduleclass = 'toolchain'
--- a/i/intel/intel-2023a.eb
+++ b/i/intel/intel-2023a.eb
@ -0,0 +1,22 @@
+easyblock = 'Toolchain'
+
+name = 'intel'
+version = '2023a'
+
+homepage = 'https://easybuild.readthedocs.io/en/master/Common-toolchains.html#intel-toolchain'
+description = "Compiler toolchain including Intel compilers, Intel MPI and Intel Math Kernel Library (MKL)."
+
+toolchain = SYSTEM
+
+local_comp_ver = '2023.1.0'
+local_gccver = '12.3.0'
+dependencies = [
+    ('GCCcore', local_gccver),
+    ('binutils', '2.40', '', ('GCCcore', local_gccver)),
+    ('intel-compilers', local_comp_ver),
+    ('impi', '2021.4.0', '', ('intel-compilers', local_comp_ver)),
+    ('imkl', local_comp_ver, '', SYSTEM),
+    ('imkl-FFTW', local_comp_ver, '', ('iimpi', version)),
+]
+
+moduleclass = 'toolchain'
--- a/l/LAre3d/LAre3d-20230726-intel-2022b-v2.eb
+++ b/l/LAre3d/LAre3d-20230726-intel-2022b-v2.eb
@ -0,0 +1,29 @@
+# IT4Innovations
+# LK
+
+easyblock = 'MakeCp'
+
+name = 'LAre3d'
+version = '20230726'
+
+homepage = 'https://github.com/Warwick-Plasma/Lare3d'
+description = "..."
+
+toolchain = {'name': 'intel', 'version': '2022b'}
+
+#source_urls = ['git clone && tar cvzf']
+sources = ['LAre3d-%(version)s.tar.gz']
+checksums = ['1865314b0ee853d658f6872078bbfdcd4c019925a1499689ed5463f42f7f3f18']
+
+buildopts = 'COMPILER=intel'
+
+files_to_copy = [
+  (['bin/lare3d'], 'bin'),  
+]
+
+sanity_check_paths = {
+    'files': ['bin/lare3d'],
+    'dirs': [],
+}
+
+moduleclass = 'tools'
--- a/l/libxml2/libxml2-2.10.3-GCCcore-12.2.0.eb
+++ b/l/libxml2/libxml2-2.10.3-GCCcore-12.2.0.eb
@ -0,0 +1,27 @@
+name = 'libxml2'
+version = '2.10.3'
+
+homepage = 'http://xmlsoft.org/'
+
+description = """
+ Libxml2 is the XML C parser and toolchain developed for the Gnome project
+ (but usable outside of the Gnome platform).
+"""
+
+toolchain = {'name': 'GCCcore', 'version': '12.2.0'}
+toolchainopts = {'pic': True}
+
+source_urls = ['https://download.gnome.org/sources/libxml2/%(version_major_minor)s/']
+sources = [SOURCE_TAR_XZ]
+checksums = ['5d2cc3d78bec3dbe212a9d7fa629ada25a7da928af432c93060ff5c17ee28a9c']
+
+builddependencies = [
+    ('binutils', '2.39'),
+]
+
+dependencies = [
+    ('XZ', '5.2.7'),
+    ('zlib', '1.2.12'),
+]
+
+moduleclass = 'lib'
--- a/l/libxml2/libxml2-2.10.3-GCCcore-12.3.0.eb
+++ b/l/libxml2/libxml2-2.10.3-GCCcore-12.3.0.eb
@ -0,0 +1,30 @@
+# IT4Innovations
+# LK 2023
+
+name = 'libxml2'
+version = '2.10.3'
+
+homepage = 'http://xmlsoft.org/'
+
+description = """
+ Libxml2 is the XML C parser and toolchain developed for the Gnome project
+ (but usable outside of the Gnome platform).
+"""
+
+toolchain = {'name': 'GCCcore', 'version': '12.3.0'}
+toolchainopts = {'pic': True}
+
+source_urls = ['https://download.gnome.org/sources/libxml2/%(version_major_minor)s/']
+sources = [SOURCE_TAR_XZ]
+checksums = ['5d2cc3d78bec3dbe212a9d7fa629ada25a7da928af432c93060ff5c17ee28a9c']
+
+builddependencies = [
+    ('binutils', '2.40'),
+]
+
+dependencies = [
+    ('XZ', '5.4.2'),
+    ('zlib', '1.2.12'),
+]
+
+moduleclass = 'lib'
--- a/n/networkx/networkx-2.5-fosscuda-2020b.eb
+++ b/n/networkx/networkx-2.5-fosscuda-2020b.eb
@ -0,0 +1,27 @@
+# IT4Innovations
+# LK 2023
+
+easyblock = 'PythonPackage'
+
+name = 'networkx'
+version = '2.5'
+
+homepage = 'https://pypi.python.org/pypi/networkx'
+description = """NetworkX is a Python package for the creation, manipulation,
+and study of the structure, dynamics, and functions of complex networks."""
+
+toolchain = {'name': 'fosscuda', 'version': '2020b'}
+
+sources = [SOURCE_TAR_GZ]
+checksums = ['7978955423fbc9639c10498878be59caf99b44dc304c2286162fd24b458c1602']
+
+dependencies = [
+    ('Python', '3.8.6'),
+#    ('SciPy-bundle', '2020.11'),  # required for numpy, scipy, ...
+]
+
+use_pip = True
+download_dep_fail = True
+sanity_pip_check = True
+
+moduleclass = 'tools'
--- a/o/OpenMPI/OpenMPI-4.1.4-GCC-11.3.0.eb
+++ b/o/OpenMPI/OpenMPI-4.1.4-GCC-11.3.0.eb
@ -41,7 +41,6 @@ configopts += '--with-hwloc=$EBROOTHWLOC '  # hwloc support
 configopts += '--with-slurm ' # Enable slurm
 configopts += '--enable-mpi-cxx '  # Enable building the C++ MPI bindings
 configopts += '--with-ucx=$EBROOTUCX '
-configopts += '--with-pmix=/opt/it4i-libs/PMIx/4.2.6 '

 osdependencies = [('libibverbs-dev', 'libibverbs-devel', 'rdma-core-devel')]

--- a/o/OpenMPI/OpenMPI-4.1.5-GCC-12.2.0.eb
+++ b/o/OpenMPI/OpenMPI-4.1.5-GCC-12.2.0.eb
@ -7,7 +7,7 @@ version = '4.1.5'
 homepage = 'https://www.open-mpi.org/'
 description = """The Open MPI Project is an open source MPI-3 implementation."""

-toolchain = {'name': 'GCC', 'version': '12.3.0'}
+toolchain = {'name': 'GCC', 'version': '12.2.0'}

 source_urls = ['https://www.open-mpi.org/software/ompi/v%(version_major_minor)s/downloads']
 sources = [SOURCELOWER_TAR_BZ2]
@ -24,19 +24,19 @@ checksums = [
 ]

 builddependencies = [
-    ('pkgconf', '1.9.5'),
-    ('Perl', '5.36.1'),
+    ('pkgconf', '1.9.3'),
+    ('Perl', '5.36.0'),
    ('Autotools', '20220317'),
 ]

 dependencies = [
-    ('zlib', '1.2.13'),
-    ('hwloc', '2.9.1'),
+    ('zlib', '1.2.12'),
+    ('hwloc', '2.8.0'),
    ('libevent', '2.1.12'),
    ('UCX', '1.14.1'),
-    ('libfabric', '1.18.0'),
-    ('PMIx', '4.2.4'),
-    ('UCC', '1.2.0'),
+    ('libfabric', '1.16.1'),
+    ('PMIx', '4.2.6'),
+    ('UCC', '1.1.0'),
 ]

 # Update configure to include changes from the "internal-cuda" patch
@ -55,12 +55,12 @@ preconfigopts = ' && '.join([

 # CUDA related patches and custom configure option can be removed if CUDA support isn't wanted.
 configopts = '--with-cuda=internal '
-
-# disable MPI1 compatibility for now, see what breaks...
-# configopts += '--enable-mpi1-compatibility '
-
-# to enable SLURM integration (site-specific)
-# configopts += '--with-slurm --with-pmi=/usr/include/slurm --with-pmi-libdir=/usr'
+configopts += '--enable-shared --enable-mpi-thread-multiple --with-verbs '
+configopts += '--enable-mpirun-prefix-by-default '
+configopts += '--with-hwloc=$EBROOTHWLOC '  # hwloc support
+configopts += '--with-slurm ' # Enable slurm
+configopts += '--enable-mpi-cxx '  # Enable building the C++ MPI bindings
+configopts += '--with-ucx=$EBROOTUCX '

 import os
 if os.environ.get("CLUSTERNAME") in ["BARBORA"]:
--- a/o/OpenMPI/OpenMPI-4.1.5-NVHPC-23.5-CUDA-12.2.0.eb
+++ b/o/OpenMPI/OpenMPI-4.1.5-NVHPC-23.5-CUDA-12.2.0.eb
@ -74,7 +74,6 @@ configopts += ' --with-slurm' # Enable slurm
 configopts += ' --enable-mpi-cxx'  # Enable building the C++ MPI bindings
 configopts += ' --with-ucx=$EBROOTUCX'
 configopts += ' --with-knem=/opt/knem-1.1.4.90mlnx1'
-configopts += ' --with-pmix=/opt/it4i-libs/PMIx/4.2.6'

 osdependencies = [('libibverbs-dev', 'libibverbs-devel', 'rdma-core-devel')]

--- a/p/PMIx/PMIx-4.2.6-GCC-12.2.0.eb
+++ b/p/PMIx/PMIx-4.2.6-GCC-12.2.0.eb
@ -0,0 +1,48 @@
+# IT4Innovations
+# LK 2023
+
+easyblock = 'ConfigureMake'
+
+name = 'PMIx'
+version = '4.2.6'
+
+homepage = 'https://pmix.org/'
+description = """Process Management for Exascale Environments
+PMI Exascale (PMIx) represents an attempt to
+provide an extended version of the PMI standard specifically designed
+to support clusters up to and including exascale sizes. The overall
+objective of the project is not to branch the existing pseudo-standard
+definitions - in fact, PMIx fully supports both of the existing PMI-1
+and PMI-2 APIs - but rather to (a) augment and extend those APIs to
+eliminate some current restrictions that impact scalability, and (b)
+provide a reference implementation of the PMI-server that demonstrates
+the desired level of scalability.
+"""
+
+toolchain = {'name': 'GCC', 'version': '12.2.0'}
+toolchainopts = {'pic': True}
+
+source_urls = ['https://github.com/openpmix/openpmix/releases/download/v%(version)s']
+sources = ['%(namelower)s-%(version)s.tar.bz2']
+checksums = ['10b0d5a7fca70272e9427c677557578ac452cea02aeb00e30dec2116d20c3cd0']
+
+builddependencies = [('binutils', '2.39')]
+
+dependencies = [
+    ('zlib', '1.2.12'),
+    ('libevent', '2.1.12'),
+    ('hwloc', '2.8.0'),
+]
+
+configopts = ' --with-libevent=$EBROOTLIBEVENT --with-zlib=$EBROOTZLIB'
+configopts += ' --with-hwloc=$EBROOTHWLOC'
+configopts += ' --enable-pmix-binaries'
+
+buildopts = 'V=1'
+
+sanity_check_paths = {
+    'files': ['bin/pevent', 'bin/plookup', 'bin/pmix_info', 'bin/pps'],
+    'dirs': ['etc', 'include', 'lib', 'share']
+}
+
+moduleclass = 'lib'
--- a/p/PyTorch/PyTorch-1.10.0-fosscuda-2020b.eb
+++ b/p/PyTorch/PyTorch-1.10.0-fosscuda-2020b.eb
@ -0,0 +1,150 @@
+# IT4Innovations
+# LK 2023
+
+name = 'PyTorch'
+version = '1.10.0'
+
+homepage = 'https://pytorch.org/'
+description = """Tensors and Dynamic neural networks in Python with strong GPU acceleration.
+PyTorch is a deep learning framework that puts Python first."""
+
+toolchain = {'name': 'fosscuda', 'version': '2020b'}
+
+source_urls = [GITHUB_RELEASE]
+sources = ['%(namelower)s-v%(version)s.tar.gz']
+
+patches = [
+    'PyTorch-1.7.0_avoid-nan-in-test-torch.patch',
+    'PyTorch-1.7.0_disable-dev-shm-test.patch',
+    'PyTorch-1.7.1_correctly-pass-jit_opt_level.patch',
+    'PyTorch-1.8.1_dont-use-gpu-ccc-in-test.patch',
+    'PyTorch-1.8.1_increase-distributed-test-timeout.patch',
+    'PyTorch-1.9.0_limit-world-size-for-zero-redundancy-opt-test.patch',
+    'PyTorch-1.10.0_add-dummy-bfloat16-for-ppc.patch',
+    'PyTorch-1.10.0_fix-alias-violation-in-bitwise-ops.patch',
+    'PyTorch-1.10.0_fix-faulty-asserts.patch',
+    'PyTorch-1.10.0_fix-fp16-quantization-without-fbgemm.patch',
+    'PyTorch-1.10.0_fix-kineto-crash.patch',
+    'PyTorch-1.10.0_fix-missing-VSX-dispatch.patch',
+    'PyTorch-1.10.0_fix-test-cond-cpu.patch',
+    'PyTorch-1.10.0_fix-test-dataloader-fixed-affinity.patch',
+    'PyTorch-1.10.0_fix-test-model_dump.patch',
+    'PyTorch-1.10.0_fix-vnni-detection.patch',
+    'PyTorch-1.10.0_fix-vsx-vector-functions.patch',
+    'PyTorch-1.10.0_fix-XNNPACK-tests.patch',
+    'PyTorch-1.10.0_increase_zero_optimizer_test_tolerance.patch',
+    'PyTorch-1.10.0_remove-vec-dump-functions.patch',
+    'PyTorch-1.10.0_skip_cmake_rpath.patch',
+    'PyTorch-1.10.0_skip_failing_ops_tests.patch',
+    'PyTorch-1.10.0_skip_nan_tests_openblas.patch',
+    'PyTorch-1.10.0_skip-nnapi-test-without-qnnpack.patch',
+]
+checksums = [
+    '1970225700d1f9791eb553855ad3c22e7c9fd69cff2765d532506b33e449831e',  # pytorch-v1.10.0.tar.gz
+    'b899aa94d9e60f11ee75a706563312ccefa9cf432756c470caa8e623991c8f18',  # PyTorch-1.7.0_avoid-nan-in-test-torch.patch
+    '622cb1eaeadc06e13128a862d9946bcc1f1edd3d02b259c56a9aecc4d5406b8a',  # PyTorch-1.7.0_disable-dev-shm-test.patch
+    # PyTorch-1.7.1_correctly-pass-jit_opt_level.patch
+    'd4d967d47f8a6172fcbf57f0a61835482968850967c4fdb01108b720696a988d',
+    '89ac7a8e9e7df2e64cf8404fe3a279f5e9b759fee41c9de3aaff9c22f385c2c6',  # PyTorch-1.8.1_dont-use-gpu-ccc-in-test.patch
+    # PyTorch-1.8.1_increase-distributed-test-timeout.patch
+    '7a6e512274f0b8673f4f207a5bc53387d88be7e79833f42d20365668b2118071',
+    # PyTorch-1.9.0_limit-world-size-for-zero-redundancy-opt-test.patch
+    'ff573660913ce055e24cfd194ce747ba5685091c631cfd443eae2a99d56b57ea',
+    # PyTorch-1.10.0_add-dummy-bfloat16-for-ppc.patch
+    '0c8bf4b284c5c2cb4d175645d44bed674cca5218de741a8ea698cef2884a86da',
+    # PyTorch-1.10.0_fix-alias-violation-in-bitwise-ops.patch
+    '426c9ead1a74b656748d4c8bf8afd4303d8b9f2394ad22b21a845d07c8ca1d12',
+    # PyTorch-1.10.0_fix-faulty-asserts.patch
+    '44d2bb998ec3b3b65659f3327894745888a58f957a191cb524b4003018db51a2',
+    # PyTorch-1.10.0_fix-fp16-quantization-without-fbgemm.patch
+    'dfc09c2e787e757191a0ebf68ace46e2a90d71263ba84e2ee764b596d2ee6769',
+    # PyTorch-1.10.0_fix-kineto-crash.patch
+    'dc467333b28162149af8f675929d8c6bf219f23230bfc0d39af02ba4f6f882eb',
+    # PyTorch-1.10.0_fix-missing-VSX-dispatch.patch
+    '29368e69e98cb16659a2043b7a0df0411c99bc57a70405f8b5300f68c25f3ee9',
+    # PyTorch-1.10.0_fix-test-cond-cpu.patch
+    '51f83f5d5ef69656ef35b73f17e0671e70113798421be11ea4c7b56ffcc4da03',
+    # PyTorch-1.10.0_fix-test-dataloader-fixed-affinity.patch
+    '313dca681f45ce3bc7c4557fdcdcbe0b77216d2c708fa30a2ec0e22c44876707',
+    # PyTorch-1.10.0_fix-test-model_dump.patch
+    '339148ae1a028cda6e750ac93fa38a599f66c7abe26586c9219f1a206ea14557',
+    # PyTorch-1.10.0_fix-vnni-detection.patch
+    '1f3664c0febfa2a3fc4c0cd3bae185f289716ac0b6c3d7e8fa1cee19ba62b7cc',
+    # PyTorch-1.10.0_fix-vsx-vector-functions.patch
+    '7bef5f96cb83b2d655d2f76dd7468a171d446f0b3e06da2232ec7f886484d312',
+    # PyTorch-1.10.0_fix-XNNPACK-tests.patch
+    'd3e749a2a42efce463e3b8a1aebb21f0edf2256682c4417297d9a44a6210e5f8',
+    # PyTorch-1.10.0_increase_zero_optimizer_test_tolerance.patch
+    'e65afb01786f7f030ccb5faada1eb474bb0c418bcadcf1baaa71a4fa2f3f4240',
+    # PyTorch-1.10.0_remove-vec-dump-functions.patch
+    '5e796c83f74e77aa193fef2720a7a41e3e0eb39df726a6f0a2a1c55d37d8fcc8',
+    # PyTorch-1.10.0_skip_cmake_rpath.patch
+    'ac05943bb205623f91ef140aa00869efc5fe844184bd666bebf5405808610448',
+    # PyTorch-1.10.0_skip_failing_ops_tests.patch
+    '399af94ffcef4a6db5226552c46f11e9b0f0f371b2d7924b9e5764d2281581ab',
+    # PyTorch-1.10.0_skip_nan_tests_openblas.patch
+    '7d3f83e3056d9e47a460790313238f28708beb596cafaa7ae55e374d368bbedf',
+    # PyTorch-1.10.0_skip-nnapi-test-without-qnnpack.patch
+    '34ba476a7bcddec323bf9eca083cb4623d0f569d081aa3add3769c24f22849d2',
+]
+
+osdependencies = [OS_PKG_IBVERBS_DEV]
+
+builddependencies = [
+    ('CMake', '3.20.1'),   # Needs 3.20 or newer.
+    ('hypothesis', '5.41.5'),
+]
+
+dependencies = [
+    ('Ninja', '1.10.1'),  # Required for JIT compilation of C++ extensions
+    ('Python', '3.8.6'),
+    ('protobuf', '3.14.0'),
+    ('protobuf-python', '3.14.0'),
+    ('pybind11', '2.6.0'),
+ #  ('SciPy-bundle', '2020.11'),
+    ('typing-extensions', '3.7.4.3'),
+    ('PyYAML', '5.3.1'),
+    ('MPFR', '4.1.0'),
+    ('GMP', '6.2.0'),
+    ('numactl', '2.0.13'),
+    ('FFmpeg', '4.3.1'),
+    ('Pillow', '8.0.1'),
+    ('expecttest', '0.1.3'),
+    ('cuDNN', '8.0.4.30', '-CUDA-%(cudaver)s', SYSTEM),
+    ('magma', '2.5.4'),
+    ('NCCL', '2.8.3', '-CUDA-%(cudaver)s'),
+]
+
+# default CUDA compute capabilities to use (override via --cuda-compute-capabilities)
+cuda_compute_capabilities = ['3.5', '3.7', '5.2', '6.0', '6.1', '7.0', '7.2', '7.5', '8.0', '8.6']
+
+custom_opts = ["USE_CUPTI_SO=1"]
+
+excluded_tests = {
+    '': [
+        # Bad tests: https://github.com/pytorch/pytorch/issues/60260
+        'distributed/elastic/utils/distributed_test',
+        'distributed/elastic/multiprocessing/api_test',
+        # These tests fail on A10s at the very least, they time out forever no matter how long the timeout is.
+        # Possibly related to NCCL 2.8.3: https://docs.nvidia.com/deeplearning/nccl/release-notes/rel_2-8-3.html
+        # 'distributed/test_distributed_fork',
+        'distributed/test_distributed_spawn',
+        # Fails on A10s: https://github.com/pytorch/pytorch/issues/63079
+        'test_optim',
+        # Test from this suite timeout often. The process group backend is deprecated anyway
+        # 'distributed/rpc/test_process_group_agent',
+    ]
+}
+
+runtest = 'cd test && PYTHONUNBUFFERED=1 %(python)s run_test.py --continue-through-error  --verbose %(excluded_tests)s'
+
+# The readelf sanity check can be taken out once the TestRPATH test from https://github.com/pytorch/pytorch/pull/68912
+# is accepted, since it is then checked as part of the PyTorch test suite
+local_libcaffe2 = "$EBROOTPYTORCH/lib/python%%(pyshortver)s/site-packages/torch/lib/libcaffe2_nvrtc.%s" % SHLIB_EXT
+sanity_check_commands = [
+    "python -c 'import caffe2.python'",
+    "readelf -d %s | egrep 'RPATH|RUNPATH' | grep -v stubs" % local_libcaffe2,
+]
+tests = ['PyTorch-check-cpp-extension.py']
+
+moduleclass = 'devel'
--- a/p/PyTorch/PyTorch-1.13.1-foss-2022b.eb
+++ b/p/PyTorch/PyTorch-1.13.1-foss-2022b.eb
@ -0,0 +1,157 @@
+# IT4Innovations
+# LK 2023
+
+name = 'PyTorch'
+version = '1.13.1'
+
+homepage = 'https://pytorch.org/'
+description = """Tensors and Dynamic neural networks in Python with strong GPU acceleration.
+PyTorch is a deep learning framework that puts Python first."""
+
+toolchain = {'name': 'foss', 'version': '2022b'}
+
+source_urls = [GITHUB_RELEASE]
+sources = ['%(namelower)s-v%(version)s.tar.gz']
+patches = [
+    'PyTorch-1.7.0_disable-dev-shm-test.patch',
+    'PyTorch-1.10.0_fix-kineto-crash.patch',
+    'PyTorch-1.11.0_fix-fp16-quantization-without-fbgemm.patch',
+    'PyTorch-1.11.1_skip-test_init_from_local_shards.patch',
+    'PyTorch-1.12.0_fix-EmbeddingBag-without-fbgemm.patch',
+    'PyTorch-1.12.1_add-hypothesis-suppression.patch',
+    'PyTorch-1.12.1_fix-skip-decorators.patch',
+    'PyTorch-1.12.1_fix-test_cpp_extensions_jit.patch',
+    'PyTorch-1.12.1_fix-test_wishart_log_prob.patch',
+    'PyTorch-1.12.1_fix-TestTorch.test_to.patch',
+    'PyTorch-1.12.1_fix-use-after-free-in-tensorpipe-agent.patch',
+    'PyTorch-1.12.1_fix-vsx-loadu.patch',
+    'PyTorch-1.12.1_fix-vsx-vector-funcs.patch',
+    'PyTorch-1.12.1_skip-test_round_robin.patch',
+    'PyTorch-1.13.1_disable-test-sharding.patch',
+    'PyTorch-1.13.1_fix-flaky-jit-test.patch',
+    'PyTorch-1.13.1_fix-fsdp-fp16-test.patch',
+    'PyTorch-1.13.1_fix-gcc-12-missing-includes.patch',
+    'PyTorch-1.13.1_fix-gcc-12-warning-in-fbgemm.patch',
+    'PyTorch-1.13.1_fix-numpy-deprecations.patch',
+    'PyTorch-1.13.1_fix-protobuf-dependency.patch',
+    'PyTorch-1.13.1_fix-pytest-args.patch',
+    'PyTorch-1.13.1_fix-python-3.11-compat.patch',
+    'PyTorch-1.13.1_fix-test-ops-conf.patch',
+    'PyTorch-1.13.1_fix-warning-in-test-cpp-api.patch',
+    'PyTorch-1.13.1_increase-tolerance-test_ops.patch',
+    'PyTorch-1.13.1_install-vsx-vec-headers.patch',
+    'PyTorch-1.13.1_no-cuda-stubs-rpath.patch',
+    'PyTorch-1.13.1_remove-flaky-test-in-testnn.patch',
+    'PyTorch-1.13.1_skip-failing-grad-test.patch',
+    'PyTorch-1.13.1_skip-failing-singular-grad-test.patch',
+    'PyTorch-1.13.1_skip-tests-without-fbgemm.patch',
+]
+checksums = [
+    {'pytorch-v1.13.1.tar.gz': 'dbc229ee9750b02b514937d017744443a269ea0241ed3f32b9af0703589d25d4'},
+    {'PyTorch-1.7.0_disable-dev-shm-test.patch': '622cb1eaeadc06e13128a862d9946bcc1f1edd3d02b259c56a9aecc4d5406b8a'},
+    {'PyTorch-1.10.0_fix-kineto-crash.patch': 'dc467333b28162149af8f675929d8c6bf219f23230bfc0d39af02ba4f6f882eb'},
+    {'PyTorch-1.11.0_fix-fp16-quantization-without-fbgemm.patch':
+     'cc526130b6446bbbf5f0f7372d3aeee3e7d4c4d6e471524dff028b430b152934'},
+    {'PyTorch-1.11.1_skip-test_init_from_local_shards.patch':
+     '4aeb1b0bc863d4801b0095cbce69f8794066748f0df27c6aaaf729c5ecba04b7'},
+    {'PyTorch-1.12.0_fix-EmbeddingBag-without-fbgemm.patch':
+     '090598592283e3fc46ee08a68b6a6afe07be41b26514afba51834408bf1c98ed'},
+    {'PyTorch-1.12.1_add-hypothesis-suppression.patch':
+     'e71ffb94ebe69f580fa70e0de84017058325fdff944866d6bd03463626edc32c'},
+    {'PyTorch-1.12.1_fix-skip-decorators.patch': 'e3ca6e42b2fa592ea095939fb59ab875668a058479407db3f3684cc5c6f4146c'},
+    {'PyTorch-1.12.1_fix-test_cpp_extensions_jit.patch':
+     '1efc9850c431d702e9117d4766277d3f88c5c8b3870997c9974971bce7f2ab83'},
+    {'PyTorch-1.12.1_fix-test_wishart_log_prob.patch':
+     'cf475ae6e6234b96c8d1bf917597c5176c94b3ccd940b72f2e1cd0c979580f45'},
+    {'PyTorch-1.12.1_fix-TestTorch.test_to.patch': '75f27987c3f25c501e719bd2b1c70a029ae0ee28514a97fe447516aee02b1535'},
+    {'PyTorch-1.12.1_fix-use-after-free-in-tensorpipe-agent.patch':
+     '0bd7e88b92c4c6f0fecf01746009858ba19f2df68b10b88c41485328a531875d'},
+    {'PyTorch-1.12.1_fix-vsx-loadu.patch': '8bfe3c94ada1dd1f7974a1261a8b576fb7ae944050fa1c7830fca033831123b2'},
+    {'PyTorch-1.12.1_fix-vsx-vector-funcs.patch': 'caccbf60f62eac313896c1eaec78b08f5d0fdfcb907079087490bb13d1561aa2'},
+    {'PyTorch-1.12.1_skip-test_round_robin.patch': '63d4849b78605aa088fdff695637d9473ea60dee603a3ff7f788690d70c55349'},
+    {'PyTorch-1.13.1_disable-test-sharding.patch': 'df2074adeba47998ce2993d99ca64eb6f1c79ab7057f553b436efdec264d3572'},
+    {'PyTorch-1.13.1_fix-flaky-jit-test.patch': '71efdeb29b5e5b4982c9f5cb2182733654a34d52f85bb5487bc4d7d99b86101b'},
+    {'PyTorch-1.13.1_fix-fsdp-fp16-test.patch': '8ae68e60d6e1f92f50322b7f0381c7e65251fba32d7606e3a238a36a2f55b5cf'},
+    {'PyTorch-1.13.1_fix-gcc-12-missing-includes.patch':
+     '18df8c61ecaa9fb659346c1e172828bca6b069f0145bb8f6a36b0a23b7bef0a6'},
+    {'PyTorch-1.13.1_fix-gcc-12-warning-in-fbgemm.patch':
+     '5c7be91a6096083a0b1315efe0001537499c600f1f569953c6a2c7f4cc1d0910'},
+    {'PyTorch-1.13.1_fix-numpy-deprecations.patch':
+     'f461b570efe0434ddd806bf2fa7020eb213e3ed89d0eb4403e076f4276ba2a46'},
+    {'PyTorch-1.13.1_fix-protobuf-dependency.patch':
+     '8bd755a0cab7233a243bc65ca57c9630dfccdc9bf8c9792f0de4e07a644fcb00'},
+    {'PyTorch-1.13.1_fix-pytest-args.patch': 'd3e3c841cf8d73683750f29326f2be56ee0bb5df7ff522baf7d7c3f301a91ec2'},
+    {'PyTorch-1.13.1_fix-python-3.11-compat.patch':
+     'fa4eb0e27e00a90bb217b77c0023089c4659c03f37d781ab4a681bdcb4f0432f'},
+    {'PyTorch-1.13.1_fix-test-ops-conf.patch': 'df652eec7753864ebebbfeca546929a53e3fb8f24259d5c9b964266a8551198c'},
+    {'PyTorch-1.13.1_fix-warning-in-test-cpp-api.patch':
+     'bdde0f2105215c95a54de64ec4b1a4520528510663174fef6d5b900eb1db3937'},
+    {'PyTorch-1.13.1_increase-tolerance-test_ops.patch':
+     'c909fdfc2b12df457e1eb5514265ffec3eab653994949416f3f048668421e223'},
+    {'PyTorch-1.13.1_install-vsx-vec-headers.patch':
+     '7b678f54bb947afd4767f5877ac424b4b94ce5db609ea20f5a869ccf4027035f'},
+    {'PyTorch-1.13.1_no-cuda-stubs-rpath.patch': '4c636059850fc9d1ecb27ce275f8aad5d5b6fdc19e35aff0c25b86cb3201352a'},
+    {'PyTorch-1.13.1_remove-flaky-test-in-testnn.patch':
+     'be83ff61fe2dedab6d49c232936d5622df81ab49154264490021c6c828e53315'},
+    {'PyTorch-1.13.1_skip-failing-grad-test.patch': '6681200f9509893cb9231b5c93ac9bc5e6d9d9ae4febefca52e7cbc843ba8f51'},
+    {'PyTorch-1.13.1_skip-failing-singular-grad-test.patch':
+     '72688a57b2bb617665ad1a1d5e362c5111ae912c10936bb38a089c0204729f48'},
+    {'PyTorch-1.13.1_skip-tests-without-fbgemm.patch':
+     '481e595f673baf8ae58b41697a6792b83048b0264aa79b422f48cd8c22948bb7'},
+]
+
+osdependencies = [OS_PKG_IBVERBS_DEV]
+
+builddependencies = [
+    ('CMake', '3.24.3'),
+    ('hypothesis', '6.68.2'),
+    # For tests
+    ('pytest-rerunfailures', '12.0'),
+    ('pytest-shard', '0.1.2'),
+]
+
+dependencies = [
+    ('Ninja', '1.11.1'),  # Required for JIT compilation of C++ extensions
+    ('Python', '3.10.8'),
+    ('protobuf', '23.0'),
+    ('protobuf-python', '4.23.0'),
+    ('pybind11', '2.10.3'),
+#   ('SciPy-bundle', '2023.02'),
+    ('PyYAML', '6.0'),
+    ('MPFR', '4.2.0'),
+    ('GMP', '6.2.1'),
+    ('numactl', '2.0.16'),
+    ('FFmpeg', '5.1.2'),
+    ('Pillow', '9.4.0'),
+    ('expecttest', '0.1.3'),
+]
+
+custom_opts = ['CMAKE_CXX_STANDARD=17']
+
+excluded_tests = {
+    '': [
+        # This test seems to take too long on NVIDIA Ampere at least.
+        'distributed/test_distributed_spawn',
+        # Broken on CUDA 11.6/11.7: https://github.com/pytorch/pytorch/issues/75375
+        'distributions/test_constraints',
+        # no xdoctest
+        'doctests',
+        # failing on broadwell
+        # See https://github.com/easybuilders/easybuild-easyconfigs/issues/17712
+        'test_native_mha',
+        # intermittent failures on various systems
+        # See https://github.com/easybuilders/easybuild-easyconfigs/issues/17712
+        'distributed/rpc/test_tensorpipe_agent',
+    ]
+}
+
+runtest = 'cd test && PYTHONUNBUFFERED=1 %(python)s run_test.py --continue-through-error  --verbose %(excluded_tests)s'
+
+# Especially test_quantization has a few corner cases that are triggered by the random input values,
+# those cannot be easily avoided, see https://github.com/pytorch/pytorch/issues/107030
+# So allow a low number of tests to fail as the tests "usually" succeed
+max_failed_tests = 2
+
+tests = ['PyTorch-check-cpp-extension.py']
+
+moduleclass = 'ai'
--- a/p/phonopy/phonopy-2.16.3-foss-2022a.eb
+++ b/p/phonopy/phonopy-2.16.3-foss-2022a.eb
@ -0,0 +1,35 @@
+easyblock = 'PythonPackage'
+
+name = 'phonopy'
+version = '2.16.3'
+
+homepage = 'https://atztogo.github.io/phonopy/'
+description = """Phonopy is an open source package of phonon calculations based on the supercell approach."""
+
+toolchain = {'name': 'foss', 'version': '2022a'}
+
+sources = [SOURCE_TAR_GZ]
+checksums = ['c536d355156626f26e5d5fd158b03e10c4a13c461d6a02a26b05e3b6311b9d79']
+
+dependencies = [
+    ('Python', '3.10.4'),
+    ('SciPy-bundle', '2022.05'),  # for numpy
+    ('matplotlib', '3.5.2'),
+    ('PyYAML', '6.0'),
+    ('h5py', '3.7.0'),
+    ('spglib-python', '2.0.0'),
+]
+
+download_dep_fail = True
+use_pip = True
+
+sanity_check_paths = {
+    'files': ['bin/phonopy'],
+    'dirs': ['lib/python%(pyshortver)s/site-packages'],
+}
+
+sanity_check_commands = ["phonopy --help"]
+
+sanity_pip_check = True
+
+moduleclass = 'lib'
--- a/p/phonopy/phonopy-2.20.0-conda.eb
+++ b/p/phonopy/phonopy-2.20.0-conda.eb
@ -0,0 +1,27 @@
+# IT4Innovations
+# LK 2023
+
+easyblock = "Conda"
+
+name = 'phonopy'
+version = '2.20.0'
+versionsuffix = '-conda'
+
+homepage = 'http://phonopy.sourceforge.net/phono3py/index.html'
+description = """This software calculates phonon-phonon interaction related properties"""
+
+toolchain = SYSTEM
+
+dependencies = [
+    ('Anaconda3', '2022.05'),
+]
+
+requirements = "%(namelower)s numpy scipy h5py pyyaml matplotlib-base spglib"
+channels = ['conda-forge']
+
+sanity_check_paths = {
+    'files': ['bin/phonopy'],
+    'dirs': ['bin', 'lib']
+}
+
+moduleclass = 'phys'
--- a/p/phonopy/phonopy-2.20.0-foss-2022a.eb
+++ b/p/phonopy/phonopy-2.20.0-foss-2022a.eb
@ -0,0 +1,38 @@
+# IT4Innovations
+# LK 2023
+
+easyblock = 'PythonPackage'
+
+name = 'phonopy'
+version = '2.20.0'
+
+homepage = 'https://atztogo.github.io/phonopy/'
+description = """Phonopy is an open source package of phonon calculations based on the supercell approach."""
+
+toolchain = {'name': 'foss', 'version': '2022a'}
+
+sources = [SOURCE_TAR_GZ]
+checksums = ['a5e2f9d1bd6efad051c6dfd4d9296846f4bd2d378c5c48eb179177656849999e']
+
+dependencies = [
+    ('Python', '3.10.4'),
+    ('SciPy-bundle', '2022.05'),  # for numpy
+    ('matplotlib', '3.5.2'),
+    ('PyYAML', '6.0'),
+    ('h5py', '3.7.0'),
+    ('spglib-python', '2.0.0'),
+]
+
+download_dep_fail = True
+use_pip = True
+
+sanity_check_paths = {
+    'files': ['bin/phonopy'],
+    'dirs': ['lib/python%(pyshortver)s/site-packages'],
+}
+
+sanity_check_commands = ["phonopy --help"]
+
+sanity_pip_check = True
+
+moduleclass = 'lib'
--- a/u/UCX/UCX-1.14.1-GCCcore-11.3.0.eb
+++ b/u/UCX/UCX-1.14.1-GCCcore-11.3.0.eb
@ -0,0 +1,59 @@
+# IT4Innovations
+# LK 2023
+
+easyblock = 'ConfigureMake'
+
+name = 'UCX'
+version = '1.14.1'
+
+homepage = 'https://www.openucx.org/'
+description = """Unified Communication X
+An open-source production grade communication framework for data centric
+and high-performance applications
+"""
+
+toolchain = {'name': 'GCCcore', 'version': '11.3.0'}
+toolchainopts = {'pic': True}
+
+source_urls = ['https://github.com/openucx/ucx/releases/download/v%(version)s']
+sources = ['%(namelower)s-%(version)s.tar.gz']
+patches = [
+    'UCX-1.13.1-dynamic_modules.patch',
+]
+checksums = [
+    {'ucx-1.14.1.tar.gz': 'baa0634cafb269a3112f626eb226bcd2ca8c9fcf0fec3b8e2a3553baad5f77aa'},
+    {'UCX-1.13.1-dynamic_modules.patch': '00874687bd90b795fff61aaa183f6c6bea2210aa1003b28f23d9ebf7066f8782'},
+]
+
+builddependencies = [
+    ('binutils', '2.38'),
+    ('Autotools', '20220317'),
+    ('pkgconf', '1.8.0'),
+]
+
+osdependencies = [OS_PKG_IBVERBS_DEV]
+
+dependencies = [
+    ('zlib', '1.2.12'),
+    ('numactl', '2.0.14'),
+]
+
+configure_cmd = "contrib/configure-release"
+
+configopts = '--enable-optimizations --enable-cma --enable-mt --with-verbs '
+configopts += '--without-java --without-go --disable-doxygen-doc '
+
+import os
+if os.environ.get("CLUSTERNAME") in ["KAROLINA", "BARBORA"]:
+   configopts += '--with-xpmem --with-knem=/opt/knem-1.1.4.90mlnx1' 
+
+buildopts = 'V=1'
+
+sanity_check_paths = {
+    'files': ['bin/ucx_info', 'bin/ucx_perftest', 'bin/ucx_read_profile'],
+    'dirs': ['include', 'lib', 'share']
+}
+
+sanity_check_commands = ["ucx_info -d"]
+
+moduleclass = 'lib'
--- a/u/UCX/UCX-1.14.1-GCCcore-12.3.0-test.eb
+++ b/u/UCX/UCX-1.14.1-GCCcore-12.3.0-test.eb
@ -0,0 +1,60 @@
+# IT4Innovations
+# LK 2023
+
+easyblock = 'ConfigureMake'
+
+name = 'UCX'
+version = '1.14.1'
+versionsuffix = '-test'
+
+homepage = 'https://www.openucx.org/'
+description = """Unified Communication X
+An open-source production grade communication framework for data centric
+and high-performance applications
+"""
+
+toolchain = {'name': 'GCCcore', 'version': '12.3.0'}
+toolchainopts = {'pic': True}
+
+source_urls = ['https://github.com/openucx/ucx/releases/download/v%(version)s']
+sources = ['%(namelower)s-%(version)s.tar.gz']
+patches = [
+    'UCX-1.13.1-dynamic_modules.patch',
+]
+checksums = [
+    {'ucx-1.14.1.tar.gz': 'baa0634cafb269a3112f626eb226bcd2ca8c9fcf0fec3b8e2a3553baad5f77aa'},
+    {'UCX-1.13.1-dynamic_modules.patch': '00874687bd90b795fff61aaa183f6c6bea2210aa1003b28f23d9ebf7066f8782'},
+]
+
+builddependencies = [
+    ('binutils', '2.40'),
+    ('Autotools', '20220317'),
+    ('pkgconf', '1.9.5'),
+]
+
+osdependencies = [OS_PKG_IBVERBS_DEV]
+
+dependencies = [
+    ('zlib', '1.2.13'),
+    ('numactl', '2.0.16'),
+]
+
+configure_cmd = "contrib/configure-release"
+
+configopts = '--enable-optimizations --enable-cma --enable-mt --with-verbs '
+configopts += '--without-java --without-go --disable-doxygen-doc '
+
+import os
+if os.environ.get("CLUSTERNAME") in ["KAROLINA", "BARBORA"]:
+   configopts += '--with-xpmem --with-knem=/opt/knem-1.1.4.90mlnx1' 
+
+buildopts = 'V=1'
+
+sanity_check_paths = {
+    'files': ['bin/ucx_info', 'bin/ucx_perftest', 'bin/ucx_read_profile'],
+    'dirs': ['include', 'lib', 'share']
+}
+
+sanity_check_commands = ["ucx_info -d"]
+
+moduleclass = 'lib'
--- a/v/VisIt/VisIt-2.13.3.eb
+++ b/v/VisIt/VisIt-2.13.3.eb
@ -0,0 +1,29 @@
+# IT4Innovations
+# LK 2023
+
+name = 'VisIt'
+version = '2.13.3'
+
+homepage = 'https://wci.llnl.gov/simulation/local_computer-codes/visit'
+description = """VisIt is an Open Source, interactive, scalable, visualization, animation and analysis tool"""
+
+toolchain = SYSTEM
+
+source_urls = ['https://github.com/visit-dav/visit/releases/download/v%(version)s']
+sources = [
+   'visit2_13_3.linux-x86_64-rhel7.tar.gz',
+   'visit-install2_13_3'
+]
+checksums = [
+   'fb52f8405e8bbfd4d0d097255c5f0349be2c95e9da5a4ac9c4487c010005178c', # visit3_3_3.linux-x86_64-rhel7.tar.gz
+   'f18370cd7a074997753db0f0a72fced1ca3b4f293a1366227e4333456928dcc0'  # visit-install3_3_3
+]
+
+skipsteps = ['configure', 'build']
+
+sanity_check_paths = {
+    'files': ['bin/visit'],
+    'dirs': ['bin', 'current/bin'],
+}
+
+moduleclass = 'vis'
--- a/x/XZ/XZ-5.2.7-GCCcore-12.2.0.eb
+++ b/x/XZ/XZ-5.2.7-GCCcore-12.2.0.eb
@ -0,0 +1,37 @@
+##
+# Author:    Robert Mijakovic <robert.mijakovic@lxp.lu>
+##
+easyblock = 'ConfigureMake'
+
+name = 'XZ'
+version = '5.2.7'
+
+homepage = 'https://tukaani.org/xz/'
+description = "xz: XZ utilities"
+
+toolchain = {'name': 'GCCcore', 'version': '12.2.0'}
+
+source_urls = ['https://tukaani.org/xz/']
+sources = [SOURCELOWER_TAR_BZ2]
+checksums = ['b65f1d0c2708e57716f4dd2216989a73847ac6fdb4168ffceb155767e22b834b']
+
+builddependencies = [
+    # use gettext built with system toolchain as build dep to avoid cyclic dependency (XZ -> gettext -> libxml2 -> XZ)
+    ('gettext', '0.21.1', '', SYSTEM),
+    ('binutils', '2.39'),
+]
+
+# may become useful in non-x86 archs
+# configopts = ' --disable-assembler '
+
+sanity_check_paths = {
+    'files': ['bin/lzmainfo', 'bin/unxz', 'bin/xz'],
+    'dirs': []
+}
+
+sanity_check_commands = [
+    "xz --help",
+    "unxz --help",
+]
+
+moduleclass = 'tools'
--- a/x/XZ/XZ-5.2.7-GCCcore-12.3.0.eb
+++ b/x/XZ/XZ-5.2.7-GCCcore-12.3.0.eb
@ -0,0 +1,37 @@
+# IT4Innovations
+# LK 2023
+
+easyblock = 'ConfigureMake'
+
+name = 'XZ'
+version = '5.2.7'
+
+homepage = 'https://tukaani.org/xz/'
+description = "xz: XZ utilities"
+
+toolchain = {'name': 'GCCcore', 'version': '12.3.0'}
+
+source_urls = ['https://tukaani.org/xz/']
+sources = [SOURCELOWER_TAR_BZ2]
+checksums = ['b65f1d0c2708e57716f4dd2216989a73847ac6fdb4168ffceb155767e22b834b']
+
+builddependencies = [
+    # use gettext built with system toolchain as build dep to avoid cyclic dependency (XZ -> gettext -> libxml2 -> XZ)
+    ('gettext', '0.21.1', '', SYSTEM),
+    ('binutils', '2.40'),
+]
+
+# may become useful in non-x86 archs
+# configopts = ' --disable-assembler '
+
+sanity_check_paths = {
+    'files': ['bin/lzmainfo', 'bin/unxz', 'bin/xz'],
+    'dirs': []
+}
+
+sanity_check_commands = [
+    "xz --help",
+    "unxz --help",
+]
+
+moduleclass = 'tools'
--- a/z/zlib/zlib-1.2.12-GCCcore-12.2.0.eb
+++ b/z/zlib/zlib-1.2.12-GCCcore-12.2.0.eb
@ -0,0 +1,30 @@
+easyblock = 'ConfigureMake'
+
+name = 'zlib'
+version = '1.2.12'
+
+homepage = 'https://www.zlib.net/'
+description = """zlib is designed to be a free, general-purpose, legally unencumbered -- that is,
+ not covered by any patents -- lossless data-compression library for use on virtually any
+ computer hardware and operating system."""
+
+toolchain = {'name': 'GCCcore', 'version': '12.2.0'}
+toolchainopts = {'pic': True}
+
+source_urls = ['https://zlib.net/fossils']
+sources = [SOURCELOWER_TAR_GZ]
+patches = ['zlib-%(version)s_fix-CC-logic-in-configure.patch']
+checksums = [
+    '91844808532e5ce316b3c010929493c0244f3d37593afd6de04f71821d5136d9',  # zlib-1.2.12.tar.gz
+    'f35eb05334a4f8d7b40b6c5610a6369f654863b5fa1a19c2507888f918025238',  # zlib-1.2.12_fix-CC-logic-in-configure.patch
+]
+
+# use same binutils version that was used when building GCC toolchain
+builddependencies = [('binutils', '2.39', '', SYSTEM)]
+
+sanity_check_paths = {
+    'files': ['include/zconf.h', 'include/zlib.h', 'lib/libz.a', 'lib/libz.%s' % SHLIB_EXT],
+    'dirs': [],
+}
+
+moduleclass = 'lib'
--- a/z/zlib/zlib-1.2.12-GCCcore-12.3.0.eb
+++ b/z/zlib/zlib-1.2.12-GCCcore-12.3.0.eb
@ -0,0 +1,33 @@
+# IT4Innovations
+# LK 2023
+
+easyblock = 'ConfigureMake'
+
+name = 'zlib'
+version = '1.2.12'
+
+homepage = 'https://www.zlib.net/'
+description = """zlib is designed to be a free, general-purpose, legally unencumbered -- that is,
+ not covered by any patents -- lossless data-compression library for use on virtually any
+ computer hardware and operating system."""
+
+toolchain = {'name': 'GCCcore', 'version': '12.3.0'}
+toolchainopts = {'pic': True}
+
+source_urls = ['https://zlib.net/fossils']
+sources = [SOURCELOWER_TAR_GZ]
+patches = ['zlib-%(version)s_fix-CC-logic-in-configure.patch']
+checksums = [
+    '91844808532e5ce316b3c010929493c0244f3d37593afd6de04f71821d5136d9',  # zlib-1.2.12.tar.gz
+    'f35eb05334a4f8d7b40b6c5610a6369f654863b5fa1a19c2507888f918025238',  # zlib-1.2.12_fix-CC-logic-in-configure.patch
+]
+
+# use same binutils version that was used when building GCC toolchain
+builddependencies = [('binutils', '2.40', '', SYSTEM)]
+
+sanity_check_paths = {
+    'files': ['include/zconf.h', 'include/zlib.h', 'lib/libz.a', 'lib/libz.%s' % SHLIB_EXT],
+    'dirs': [],
+}
+
+moduleclass = 'lib'