diff --git a/.gitlab-ci.yml b/.gitlab-ci.yml index 408b72f0b085c60a70b536269510704fe88b7114..d88364d3cfd978c26f7bc6d39e24d0f89d857d08 100644 --- a/.gitlab-ci.yml +++ b/.gitlab-ci.yml @@ -1,20 +1,5 @@ -stages: - - test - -docs: - stage: test - image: it4innovations/docker-mdcheck:latest - script: - - mdl -r ~MD002,~MD013 *.md - pylint: stage: test image: it4innovations/docker-pycheck:latest script: - pylint --max-module-lines=3000 *.py - -shellcheck: - stage: test - image: koalaman/shellcheck-alpine:latest - script: - - shellcheck *.sh diff --git a/karolina.csv b/karolina.csv index 48691b7f4438aff9df292b1e41814b3a799e9eab..a9b31469470477df5398a2b4982e63642a409429 100644 --- a/karolina.csv +++ b/karolina.csv @@ -4,55 +4,39 @@ ABINIT/9.4.2-intel-2020b,1 ABINIT/9.4.2-intel-2021a,1 ABINIT/9.6.1-intel-2020b,1 ACTC/1.1-GCCcore-10.2.0,1 -Advisor/2021.2.0,1 -AlphaFold/2.1.2-fosscuda-2020b-TensorFlow-2.5.0,1 -Amber/20.11-foss-2020b-AmberTools-21.3,1 -Amber/20.11-fosscuda-2020b-AmberTools-21.3,1 -ambit/733c529-foss-2021b-psi4,1 AMD-uProf/3.5.671,1 AMD-uProf/4.0.341,1 -Anaconda3/2021.05,1 -Anaconda3/2021.11,1 -Anaconda3/2022.05,1 ANSYS/19.5-intel-2020b-alamerini,1 ANSYS/20.1-intel-2017c,1 +ANSYS/20.2-intel-2017c,1 ANSYS/2022R2-intel-2022a,1 ANSYS/2023R1-intel-2022a,1 -ANSYS/20.2-intel-2017c,1 ANSYS/21.1-intel-2018a,1 ANSYS/21.2-intel-2020b,1 ANSYS/21.2-intel-2020b-alamerini,1 ANSYS/22.1-intel-2020b,1 ANSYS/22.2-intel-2020b,1 -ant/1.10.11-Java-13,1 -ant/1.10.9-Java-11,1 AOCC/2.3.0-GCCcore-10.2.0,1 AOCC/3.0.0-GCCcore-10.2.0,1 AOCC/3.1.0-GCCcore-10.2.0,1 AOCC/3.1.0-GCCcore-10.3.0,1 AOCC/3.1.0-GCCcore-11.2.0,1 AOCC/3.2.0-GCCcore-11.2.0,1 -AOCL/3.0.1-AOCC-3.1.0,1 AOCL/3.0-6-GCCcore-10.2.0,1 +AOCL/3.0.1-AOCC-3.1.0,1 AOMP/13.0-2-GCCcore-10.2.0,1 -apex/20210420-fosscuda-2020b,1 -apptainer/1.1.5,1 -apptainer-wrappers/1.0,1 -aria2/1.35.0-GCCcore-10.3.0,1 -arpack-ng/3.8.0-intel-2020b,1 ASE/3.22.1-intel-2022a,1 ATK/2.36.0-GCCcore-10.3.0,1 ATK/2.36.0-GCCcore-9.3.0,1 ATK/2.38.0-GCCcore-11.3.0,1 ATK/2.38.0-GCCcore-12.2.0,1 -at-spi2-atk/2.34.2-GCCcore-9.3.0,1 -at-spi2-atk/2.38.0-GCCcore-10.3.0,1 -at-spi2-atk/2.38.0-GCCcore-11.3.0,1 -at-spi2-atk/2.38.0-GCCcore-12.2.0,1 -at-spi2-core/2.36.0-GCCcore-9.3.0,1 -at-spi2-core/2.40.2-GCCcore-10.3.0,1 -at-spi2-core/2.44.1-GCCcore-11.3.0,1 -at-spi2-core/2.46.0-GCCcore-12.2.0,1 +Advisor/2021.2.0,1 +AlphaFold/2.1.2-fosscuda-2020b-TensorFlow-2.5.0,1 +Amber/20.11-foss-2020b-AmberTools-21.3,1 +Amber/20.11-fosscuda-2020b-AmberTools-21.3,1 +Anaconda3/2021.05,1 +Anaconda3/2021.11,1 +Anaconda3/2022.05,1 Autoconf/2.69,1 Autoconf/2.69-GCCcore-10.2.0,1 Autoconf/2.69-GCCcore-9.3.0,1 @@ -80,33 +64,23 @@ Autotools/20210128-GCCcore-10.3.0,1 Autotools/20210726-GCCcore-11.2.0,1 Autotools/20220317-GCCcore-11.3.0,1 Autotools/20220317-GCCcore-12.2.0,1 -awscli/1.22.9-GCCcore-10.2.0-Python-3.8.6,1 -awscli/1.27.75-GCCcore-12.2.0-Python-3.10.8,1 +BEEF/0.1.1-intel-2020a,1 +BLIS/0.8.1-GCC-10.3.0,1 +BLIS/0.8.1-GCC-11.2.0,1 +BLIS/0.9.0-GCC-11.3.0,1 +BLIS/0.9.0-GCC-12.2.0,1 +BLIS/2.2-GCCcore-10.2.0,1 +BLIS/3.0-GCCcore-10.3.0-amd,1 +BLIS/3.0.1-GCCcore-10.2.0,1 +BLIS/3.0.1-GCCcore-10.2.0-amd,1 +BLIS/3.0.1-GCCcore-10.3.0-amd,1 +BLIS/3.1-GCCcore-11.2.0-amd,1 +BWA/0.7.17-intel-2020b,1 Bazel/3.7.2-GCCcore-10.2.0,1 Bazel/3.7.2-GCCcore-10.3.0,1 Bazel/3.7.2-GCCcore-11.2.0,1 Bazel/4.2.2-GCCcore-11.2.0,1 Bazel/5.1.1-GCCcore-11.3.0,1 -BEEF/0.1.1-intel-2020a,1 -binutils/2.27,1 -binutils/2.27-GCCcore-6.3.0,1 -binutils/2.31.1,1 -binutils/2.31.1-GCCcore-8.2.0,1 -binutils/2.32,1 -binutils/2.32-GCCcore-8.3.0,1 -binutils/2.34,1 -binutils/2.34-GCCcore-9.3.0,1 -binutils/2.35,1 -binutils/2.35-GCCcore-10.2.0,1 -binutils/2.36.1,1 -binutils/2.36.1-GCCcore-10.3.0,1 -binutils/2.37,1 -binutils/2.37-GCCcore-11.2.0,1 -binutils/2.38,1 -binutils/2.38-GCCcore-11.3.0,1 -binutils/2.38-GCCcore-12.1.0,1 -binutils/2.39,1 -binutils/2.39-GCCcore-12.2.0,1 Biopython/1.72-foss-2020b-Python-2.7.18,1 Biopython/1.78-fosscuda-2020b,1 Bison/3.0.4,1 @@ -136,18 +110,9 @@ Blender/3.2.2-GCC-10.3.0,1 Blender/3.3.1-GCC-10.3.0,1 Blender/3.4.0-GCC-10.3.0,1 Blender/3.5.1-GCC-10.3.0,1 -BLIS/0.8.1-GCC-10.3.0,1 -BLIS/0.8.1-GCC-11.2.0,1 -BLIS/0.9.0-GCC-11.3.0,1 -BLIS/0.9.0-GCC-12.2.0,1 -BLIS/2.2-GCCcore-10.2.0,1 -BLIS/3.0.1-GCCcore-10.2.0,1 -BLIS/3.0.1-GCCcore-10.2.0-amd,1 -BLIS/3.0.1-GCCcore-10.3.0-amd,1 -BLIS/3.0-GCCcore-10.3.0-amd,1 -BLIS/3.1-GCCcore-11.2.0-amd,1 Block/1.5.3-20200525-foss-2022a,1 BoltzTraP2/22.6.1-intel-2022a,1 +Boost.MPI/1.79.0-gompi-2022a,1 Boost/1.68.0-intel-2017c-serial,1 Boost/1.72.0-gompi-2020a,1 Boost/1.72.0-iimpi-2020a,1 @@ -163,45 +128,14 @@ Boost/1.79.0-GCC-11.2.0,1 Boost/1.79.0-GCC-11.3.0,1 Boost/1.79.0-intel-compilers-2022.1.0,1 Boost/1.81.0-GCC-12.2.0,1 -Boost.MPI/1.79.0-gompi-2022a,1 Brotli/1.0.9-GCCcore-11.2.0,1 Brotli/1.0.9-GCCcore-11.3.0,1 Brotli/1.0.9-GCCcore-12.2.0,1 -BWA/0.7.17-intel-2020b,1 -bwidget/1.9.15-GCCcore-11.3.0,1 -byacc/20170509,1 -bzip2/1.0.6,1 -bzip2/1.0.8,1 -bzip2/1.0.8-GCCcore-10.2.0,1 -bzip2/1.0.8-GCCcore-10.3.0,1 -bzip2/1.0.8-GCCcore-11.2.0,1 -bzip2/1.0.8-GCCcore-11.3.0,1 -bzip2/1.0.8-GCCcore-12.2.0,1 -bzip2/1.0.8-GCCcore-9.3.0,1 -cairo/1.16.0-GCCcore-10.2.0,1 -cairo/1.16.0-GCCcore-10.3.0,1 -cairo/1.16.0-GCCcore-11.2.0,1 -cairo/1.16.0-GCCcore-9.3.0,1 -cairo/1.17.4-GCCcore-11.3.0,1 -cairo/1.17.4-GCCcore-12.2.0,1 -c-ares/1.17.2-GCCcore-10.3.0,1 CDO/2.1.1-gompi-2021a,1 -CentOS/7,1 CGAL/4.14.3-gompi-2021a,1 -CGAL/5.2.4-gompi-2022b,1 CGAL/5.2-gompi-2020b,1 CGAL/5.2-iimpi-2020b,1 -Check/0.15.2-GCCcore-10.2.0,1 -Check/0.15.2-GCCcore-9.3.0,1 -CheMPS2/1.8.11-foss-2021b,1 -CheMPS2/1.8.12-foss-2022a,1 -CheMPS2/1.8.12-intel-2022a,1 -CheMPS2/1.8.9-intel-2020a,1 -CheMPS2/1.8.9-intel-2020b,1 -CheMPS2/1.8.9-intel-2021a,1 -Clang/11.0.1-GCCcore-10.2.0,1 -Clang/11.0.1-gcccuda-2020b,1 -Clang/13.0.1-GCCcore-11.3.0,1 +CGAL/5.2.4-gompi-2022b,1 CMake/3.13.1,1 CMake/3.16.0-rc3,1 CMake/3.16.2,1 @@ -218,24 +152,12 @@ CMake/3.23.1-GCCcore-11.3.0,1 CMake/3.24.3-GCCcore-12.2.0,1 COMSOL/5.2.0-COM,1 COMSOL/5.2.0-EDU,1 -CoordgenLibs/3.0.1-iimpi-2020a,1 -Cordax/20220830-foss-2020b,1 CP2K/2022.1-foss-2022a,1 CP2K/7.1-foss-2020b,1 CP2K/7.1-intel-2020b,1 CP2K/8.2-foss-2020b,1 CP2K/8.2-fosscuda-2020b,1 CPPE/0.3.1-GCC-11.3.0,1 -cppe/0.3.1-GCCcore-11.2.0,1 -CppUnit/1.15.1-GCCcore-10.3.0,1 -cppy/1.2.1-GCCcore-11.3.0,1 -ctffind/4.1.14-foss-2021a,1 -Cube/4.6-GCCcore-10.2.0,1 -CubeGUI/4.6-GCCcore-10.2.0,1 -CubeLib/4.6-GCCcore-10.2.0,1 -CubeLib/4.8-GCCcore-11.2.0,1 -CubeWriter/4.6-GCCcore-10.2.0,1 -CubeWriter/4.8-GCCcore-11.2.0,1 CUDA/10.2.89,1 CUDA/11.1.1-GCC-10.2.0,1 CUDA/11.3.1,1 @@ -250,26 +172,30 @@ CUDAcore/11.3.0,1 CUDAcore/11.3.1,1 CUDAcore/11.4.1,1 CUDAcore/11.6.0,1 -cuDNN/8.0.4.30-CUDA-11.1.1,1 -cuDNN/8.2.1.32-CUDA-11.3.1,1 -cuDNN/8.2.2.26-CUDA-11.4.1,1 -cuDNN/8.4.1.50-CUDA-11.7.0,1 -CuPy/8.5.0-fosscuda-2020b,1 -cURL/7.65.3,1 -cURL/7.69.1-GCCcore-9.3.0,1 -cURL/7.72.0,1 -cURL/7.72.0-GCCcore-10.2.0,1 -cURL/7.76.0,1 -cURL/7.76.0-GCCcore-10.3.0,1 -cURL/7.76.0-GCCcore-10.3.0-test,1 -cURL/7.78.0-GCCcore-11.2.0,1 -cURL/7.83.0-GCCcore-11.3.0,1 -cURL/7.86.0-GCCcore-12.2.0,1 -cuTENSOR/1.2.2.5-CUDA-11.1.1,1 CVXOPT/1.2.6-foss-2021a,1 +CentOS/7,1 +CheMPS2/1.8.11-foss-2021b,1 +CheMPS2/1.8.12-foss-2022a,1 +CheMPS2/1.8.12-intel-2022a,1 +CheMPS2/1.8.9-intel-2020a,1 +CheMPS2/1.8.9-intel-2020b,1 +CheMPS2/1.8.9-intel-2021a,1 +Check/0.15.2-GCCcore-10.2.0,1 +Check/0.15.2-GCCcore-9.3.0,1 +Clang/11.0.1-GCCcore-10.2.0,1 +Clang/11.0.1-gcccuda-2020b,1 +Clang/13.0.1-GCCcore-11.3.0,1 +CoordgenLibs/3.0.1-iimpi-2020a,1 +Cordax/20220830-foss-2020b,1 +CppUnit/1.15.1-GCCcore-10.3.0,1 +CuPy/8.5.0-fosscuda-2020b,1 +Cube/4.6-GCCcore-10.2.0,1 +CubeGUI/4.6-GCCcore-10.2.0,1 +CubeLib/4.6-GCCcore-10.2.0,1 +CubeLib/4.8-GCCcore-11.2.0,1 +CubeWriter/4.6-GCCcore-10.2.0,1 +CubeWriter/4.8-GCCcore-11.2.0,1 Cython/0.29.22-GCCcore-10.2.0,1 -Dakota/6.15.0-foss-2021b,1 -Dakota/6.15.0-intel-2021b,1 DB/18.1.32-GCCcore-9.3.0,1 DB/18.1.40-GCCcore-10.2.0,1 DB/18.1.40-GCCcore-10.3.0,1 @@ -283,35 +209,31 @@ DBus/1.13.18-GCCcore-10.3.0,1 DBus/1.13.18-GCCcore-11.2.0,1 DBus/1.14.0-GCCcore-11.3.0,1 DBus/1.15.2-GCCcore-12.2.0,1 -deepdiff/4.0.6-GCCcore-9.3.0-Python-3.8.2,1 -deepdiff/5.7.0-GCCcore-11.2.0,1 +DFT-D3/3.2.0-intel-compilers-2021.2.0,1 +DFT-D3/3.2.0-intel-compilers-2022.1.0,1 DFTB+/21.1-intel-2020b-Python-3.8.6-karolina,1 DFTB+/21.2-intel-2020b,1 DFTB+/21.2-intel-2020b-Python-3.8.6,1 DFTB+/21.2-intel-2020b-TB,1 DFTB+/22.1-intel-2020b,1 DFTB+/22.1-intel-2020b-ARPACK,1 -DFT-D3/3.2.0-intel-compilers-2021.2.0,1 -DFT-D3/3.2.0-intel-compilers-2022.1.0,1 -dftd3-lib/0.9.2-GCC-10.2.0,1 -dftd3-lib/0.9-GCC-9.3.0,1 -Dice/20221025-foss-2022a,1 -dill/0.3.4-GCCcore-10.3.0,1 -dill/0.3.4-GCCcore-11.2.0,1 -dill/0.3.6-GCCcore-11.3.0,1 -dkh/1.2-foss-2021b-psi4,1 DL_MG/2.1.4-intel-2021b,1 -double-conversion/3.1.5-GCCcore-10.2.0,1 -double-conversion/3.1.5-GCCcore-10.3.0,1 -double-conversion/3.1.5-GCCcore-11.2.0,1 -double-conversion/3.2.0-GCCcore-11.3.0,1 -double-conversion/3.2.1-GCCcore-12.2.0,1 +Dakota/6.15.0-foss-2021b,1 +Dakota/6.15.0-intel-2021b,1 +Dice/20221025-foss-2022a,1 Doxygen/1.8.17-GCCcore-9.3.0,1 Doxygen/1.8.20-GCCcore-10.2.0,1 Doxygen/1.9.1-GCCcore-10.3.0,1 Doxygen/1.9.4-GCCcore-11.3.0,1 Doxygen/1.9.5-GCCcore-12.2.0,1 DualSPHysics/5.0.175-GCC-11.2.0-CUDA-11.6.0,1 +ELPA/2019.11.001-intel-2020b,1 +ELPA/2020.11.001-fosscuda-2020b,1 +ELPA/2020.11.001-intel-2020b,1 +ELPA/2021.05.001-intel-2021a,1 +ELPA/2021.11.001-intel-2022a,1 +ELSI/2.5.0-intel-2020b,1 +ELSI/2.6.4-intel-2020b,1 EasyBuild/4.3.3,1 EasyBuild/4.3.4,1 EasyBuild/4.4.0,1 @@ -327,7 +249,6 @@ EasyBuild/4.6.1,1 EasyBuild/4.6.2,1 EasyBuild/4.7.0,1 EasyBuild/4.7.1,1 -ecCodes/2.22.1-gompi-2021a,1 Eigen/3.3.7,1 Eigen/3.3.7-GCCcore-9.3.0,1 Eigen/3.3.8-GCCcore-10.2.0,1 @@ -336,43 +257,19 @@ Eigen/3.3.9-GCCcore-11.2.0,1 Eigen/3.4.0-GCCcore-11.2.0,1 Eigen/3.4.0-GCCcore-11.3.0,1 Eigen/3.4.0-GCCcore-12.2.0,1 -elfutils/0.183-GCCcore-10.2.0,1 -elfutils/0.185-GCCcore-11.2.0,1 -elfutils/0.187-GCCcore-11.3.0,1 -elfutils/0.189-GCCcore-12.2.0,1 -ELPA/2019.11.001-intel-2020b,1 -ELPA/2020.11.001-fosscuda-2020b,1 -ELPA/2020.11.001-intel-2020b,1 -ELPA/2021.05.001-intel-2021a,1 -ELPA/2021.11.001-intel-2022a,1 -ELSI/2.5.0-intel-2020b,1 -ELSI/2.6.4-intel-2020b,1 -expat/2.2.0,1 -expat/2.2.9,1 -expat/2.2.9-GCCcore-10.2.0,1 -expat/2.2.9-GCCcore-10.3.0,1 -expat/2.2.9-GCCcore-9.3.0,1 -expat/2.4.1-GCCcore-11.2.0,1 -expat/2.4.8-GCCcore-11.3.0,1 -expat/2.4.9-GCCcore-12.2.0,1 -expecttest/0.1.3-GCCcore-10.2.0,1 -expecttest/0.1.3-GCCcore-10.3.0,1 Extrae/3.8.3-gompi-2021a,1 -Fedora/latest,1 -FFmpeg/4.3.1-GCCcore-10.2.0,1 -FFmpeg/4.3.2-GCCcore-10.3.0,1 -FFmpeg/5.0.1-GCCcore-11.3.0,1 -FFmpeg/5.1.2-GCCcore-11.3.0,1 -FFmpeg/5.1.2-GCCcore-12.2.0,1 -ffnvcodec/11.1.5.2,1 +FFTW.MPI/3.3.10-gompi-2022a,1 +FFTW.MPI/3.3.10-gompi-2022b,1 +FFTW.MPI/3.3.8-NVHPC-22.2,1 FFTW/3.3.10-GCC-11.3.0,1 FFTW/3.3.10-GCC-12.2.0,1 +FFTW/3.3.10-NVHPC-21.9,1 FFTW/3.3.10-gompi-2021b,1 FFTW/3.3.10-gompi-2021b-amd,1 FFTW/3.3.10-iimpi-2022a,1 -FFTW/3.3.10-NVHPC-21.9,1 FFTW/3.3.7-gompi-2018a,1 FFTW/3.3.8,1 +FFTW/3.3.8-NVHPC-22.2,1 FFTW/3.3.8-gompi-2020a,1 FFTW/3.3.8-gompi-2020a-amd,1 FFTW/3.3.8-gompi-2020b,1 @@ -380,90 +277,42 @@ FFTW/3.3.8-gompic-2020b,1 FFTW/3.3.8-iccifort-2020.4.304,1 FFTW/3.3.8-intel-2020a,1 FFTW/3.3.8-intel-2020b,1 -FFTW/3.3.8-NVHPC-22.2,1 FFTW/3.3.9-gompi-2021a,1 FFTW/3.3.9-intel-2021a,1 -FFTW.MPI/3.3.10-gompi-2022a,1 -FFTW.MPI/3.3.10-gompi-2022b,1 -FFTW.MPI/3.3.8-NVHPC-22.2,1 -fio/3.32-GCCcore-11.3.0,1 +FFmpeg/4.3.1-GCCcore-10.2.0,1 +FFmpeg/4.3.2-GCCcore-10.3.0,1 +FFmpeg/5.0.1-GCCcore-11.3.0,1 +FFmpeg/5.1.2-GCCcore-11.3.0,1 +FFmpeg/5.1.2-GCCcore-12.2.0,1 FLAC/1.3.1,1 FLAC/1.3.3-GCCcore-10.2.0,1 FLAC/1.3.3-GCCcore-10.3.0,1 FLAC/1.3.4-GCCcore-11.3.0,1 FLAC/1.4.2-GCCcore-12.2.0,1 +FLINT/2.7.1-GCC-10.3.0,1 +FLTK/1.3.5-GCCcore-10.2.0,1 +FLTK/1.3.6-GCCcore-10.3.0,1 +FPM/1.15.0-Ruby-3.0.3,1 +FPM/1.3.3-Ruby-2.1.6,1 +Fedora/latest,1 Flask/2.2.2-GCCcore-11.3.0,1 -flatbuffers/1.12.0-GCCcore-10.2.0,1 -flatbuffers/2.0.0-GCCcore-10.3.0,1 -flatbuffers/2.0.0-GCCcore-11.2.0,1 -flatbuffers/2.0.0-GCCcore-11.3.0,1 -flatbuffers/2.0.7-GCCcore-11.3.0,1 -flatbuffers-python/1.12-GCCcore-10.2.0,1 -flatbuffers-python/2.0-GCCcore-10.3.0,1 -flatbuffers-python/2.0-GCCcore-11.2.0,1 -flatbuffers-python/2.0-GCCcore-11.3.0,1 -flex/2.6.3,1 -flex/2.6.4,1 -flex/2.6.4-GCCcore-10.2.0,1 -flex/2.6.4-GCCcore-10.3.0,1 -flex/2.6.4-GCCcore-11.2.0,1 -flex/2.6.4-GCCcore-11.3.0,1 -flex/2.6.4-GCCcore-12.1.0,1 -flex/2.6.4-GCCcore-12.2.0,1 -flex/2.6.4-GCCcore-8.3.0,1 -flex/2.6.4-GCCcore-9.3.0,1 FlexiBLAS/3.0.4-GCC-10.3.0,1 FlexiBLAS/3.0.4-GCC-11.2.0,1 FlexiBLAS/3.2.0-GCC-11.3.0,1 FlexiBLAS/3.2.1-GCC-12.2.0,1 -FLINT/2.7.1-GCC-10.3.0,1 -FLTK/1.3.5-GCCcore-10.2.0,1 -FLTK/1.3.6-GCCcore-10.3.0,1 +FoX/4.1.2-intel-2020b,1 FoldX/5.0,1 -fontconfig/2.13.92-GCCcore-10.2.0,1 -fontconfig/2.13.92-GCCcore-9.3.0,1 -fontconfig/2.13.93,1 -fontconfig/2.13.93-GCCcore-10.3.0,1 -fontconfig/2.13.94-GCCcore-11.2.0,1 -fontconfig/2.14.0-GCCcore-11.3.0,1 -fontconfig/2.14.1-GCCcore-12.2.0,1 Forge/19.1.1,1 Forge/20.1.1,1 Forge/21.1.3,1 Forge/22.0.2,1 -foss/2018a,1 -foss/2020a,1 -foss/2020b,1 -foss/2021a,1 -foss/2021b,1 -foss/2022a,1 -foss/2022b,1 -fosscuda/2020b,1 -FoX/4.1.2-intel-2020b,1 -FPM/1.15.0-Ruby-3.0.3,1 -FPM/1.3.3-Ruby-2.1.6,1 -freetype/2.10.1-GCCcore-9.3.0,1 -freetype/2.10.3-GCCcore-10.2.0,1 -freetype/2.10.4,1 -freetype/2.10.4-GCCcore-10.3.0,1 -freetype/2.11.0-GCCcore-11.2.0,1 -freetype/2.12.1-GCCcore-11.3.0,1 -freetype/2.12.1-GCCcore-12.2.0,1 -freetype/2.9.1-libpng-1.6.34,1 FriBidi/1.0.10-GCCcore-10.2.0,1 FriBidi/1.0.10-GCCcore-10.3.0,1 FriBidi/1.0.12-GCCcore-11.3.0,1 FriBidi/1.0.12-GCCcore-12.2.0,1 FriBidi/1.0.9-GCCcore-9.3.0,1 -fromage/1.1.0-foss-2021b,1 GATK/4.1.9.0-GCCcore-10.2.0-Java-11,1 GATK/4.2.0.0-GCCcore-10.2.0-Java-11,1 -gau2grid/2.0.7-foss-2021b-lmax-5-psi4,1 -gau2grid/2.0.7-foss-2022a-lmax-5-psi4,1 -Gaussian/09-a02,1 -Gaussian/09-d01,1 -Gaussian/16_rev_c2,1 -gc/7.6.12-GCCcore-9.3.0,1 GCC/10.2.0,1 GCC/10.3.0,1 GCC/11.2.0,1 @@ -484,14 +333,8 @@ GCCcore/6.3.0,1 GCCcore/8.2.0,1 GCCcore/8.3.0,1 GCCcore/9.3.0,1 -gcccuda/2020b,1 -gcccuda/2022b,1 GDAL/3.2.1-foss-2020b,1 GDAL/3.3.0-foss-2021a,1 -Gdk-Pixbuf/2.42.10-GCCcore-12.2.0,1 -Gdk-Pixbuf/2.42.6-GCCcore-10.3.0,1 -Gdk-Pixbuf/2.42.8-GCCcore-11.3.0,1 -gdma/2.2.6-foss-2021b,1 GDRCopy/2.1-GCCcore-10.2.0-CUDA-11.1.1,1 GDRCopy/2.1-NVHPC-21.2-CUDA-11.2.2,1 GDRCopy/2.1-NVHPC-21.2-CUDA-11.3.0,1 @@ -502,50 +345,16 @@ GDRCopy/2.3-GCCcore-11.2.0,1 GDRCopy/2.3-GCCcore-11.3.0,1 GDRCopy/2.3-GCCcore-12.2.0,1 GDRCopy/2.3-NVHPC-21.9-CUDA-11.4.1,1 -geopy/2.1.0-GCCcore-10.2.0,1 GEOS/3.9.1-GCC-10.2.0,1 GEOS/3.9.1-GCC-10.3.0,1 -gettext/0.19.4,1 -gettext/0.20.1,1 -gettext/0.20.1-GCCcore-9.3.0,1 -gettext/0.21,1 -gettext/0.21.1,1 -gettext/0.21.1-GCCcore-12.2.0,1 -gettext/0.21-GCCcore-10.2.0,1 -gettext/0.21-GCCcore-10.3.0,1 -gettext/0.21-GCCcore-11.2.0,1 -gettext/0.21-GCCcore-11.3.0,1 -gfbf/2022b,1 -gh/2.14.7,1 -Ghostscript/9.53.3-GCCcore-10.2.0,1 -Ghostscript/9.54.0-GCCcore-10.3.0,1 -giflib/5.2.1-GCCcore-10.2.0,1 -giflib/5.2.1-GCCcore-10.3.0,1 -giflib/5.2.1-GCCcore-11.2.0,1 -giflib/5.2.1-GCCcore-11.3.0,1 -git/2.28.0-GCCcore-10.2.0-nodocs,1 -git/2.31.1,1 -git/2.32.0-GCCcore-10.3.0-nodocs,1 -git/2.32.0-GCCcore-10.3.0-nodocs-test,1 -git/2.33.1-GCCcore-11.2.0-nodocs,1 -git/2.36.0-GCCcore-11.3.0-nodocs,1 -git/2.38.1,1 -git/2.38.1-GCCcore-12.2.0-nodocs,1 -git-lfs/3.1.2,1 +GLPK/4.65-GCCcore-10.2.0,1 +GLPK/5.0-GCCcore-10.3.0,1 GLib/2.64.1-GCCcore-9.3.0,1 GLib/2.66.1-GCCcore-10.2.0,1 GLib/2.68.2-GCCcore-10.3.0,1 GLib/2.69.1-GCCcore-11.2.0,1 GLib/2.72.1-GCCcore-11.3.0,1 GLib/2.75.0-GCCcore-12.2.0,1 -glibc/2.19,1 -glibc/2.30-GCCcore-10.2.0,1 -glibc/2.37-GCCcore-12.2.0,1 -GlobalArrays/5.8.1-intel-2022a,1 -GlobalArrays/5.8-intel-2020b,1 -GlobalArrays/5.8-intel-2021a,1 -GLPK/4.65-GCCcore-10.2.0,1 -GLPK/5.0-GCCcore-10.3.0,1 GMP/5.0.5,1 GMP/6.1.2,1 GMP/6.2.0-GCCcore-10.2.0,1 @@ -554,55 +363,12 @@ GMP/6.2.1-GCCcore-10.3.0,1 GMP/6.2.1-GCCcore-11.2.0,1 GMP/6.2.1-GCCcore-11.3.0,1 GMP/6.2.1-GCCcore-12.2.0,1 -gmpy2/2.1.0b5-GCC-10.2.0,1 -gmpy2/2.1.0b5-GCC-10.3.0,1 -gnuplot/5.2.3,1 -gnuplot/5.2.8,1 -gnuplot/5.4.1-GCCcore-10.2.0,1 -gnuplot/5.4.2-GCCcore-10.3.0,1 -gnuplot/5.4.6-GCCcore-12.2.0,1 -Go/1.13.5,1 -Go/1.17.3,1 -Go/1.17.6,1 -Go/1.18.1,1 GObject-Introspection/1.64.0-GCCcore-9.3.0-Python-3.8.2,1 GObject-Introspection/1.66.1-GCCcore-10.2.0,1 GObject-Introspection/1.68.0-GCCcore-10.3.0,1 GObject-Introspection/1.68.0-GCCcore-11.2.0,1 GObject-Introspection/1.72.0-GCCcore-11.3.0,1 GObject-Introspection/1.74.0-GCCcore-12.2.0,1 -gompi/2018a,1 -gompi/2020a,1 -gompi/2020b,1 -gompi/2020c,1 -gompi/2021a,1 -gompi/2021b,1 -gompi/2022.05,1 -gompi/2022a,1 -gompi/2022b,1 -gompic/2020b,1 -googletest/1.11.0-GCCcore-10.3.0,1 -googletest/1.11.0-GCCcore-11.2.0,1 -gperf/3.1,1 -gperf/3.1-GCCcore-10.2.0,1 -gperf/3.1-GCCcore-10.3.0,1 -gperf/3.1-GCCcore-11.2.0,1 -gperf/3.1-GCCcore-11.3.0,1 -gperf/3.1-GCCcore-12.2.0,1 -gperf/3.1-GCCcore-9.3.0,1 -gperftools/2.8-GCCcore-9.3.0,1 -grace/5.1.25-gompi-2022a,1 -Graphene/1.10.8-GCCcore-12.2.0,1 -graphite2/1.3.14-GCCcore-10.2.0,1 -graphite2/1.3.14-GCCcore-11.2.0,1 -graphite2/1.3.14-GCCcore-11.3.0,1 -graphite2/1.3.14-GCCcore-12.2.0,1 -groff/1.22.4-GCCcore-10.2.0,1 -groff/1.22.4-GCCcore-10.3.0,1 -groff/1.22.4-GCCcore-11.2.0,1 -groff/1.22.4-GCCcore-11.3.0,1 -groff/1.22.4-GCCcore-12.2.0,1 -groff/1.22.4-GCCcore-9.3.0,1 GROMACS/2018.1-intel-2017c-double-PLUMED,1 GROMACS/2018.1-intel-2017c-hybrid-single-PLUMED,1 GROMACS/2018.8-fosscuda-2020b-PLUMED-5.6-switch,1 @@ -631,26 +397,23 @@ GStreamer/1.22.1-GCCcore-12.2.0,1 GTK3/3.24.29-GCCcore-10.3.0,1 GTK3/3.24.33-GCCcore-11.3.0,1 GTK3/3.24.35-GCCcore-12.2.0,1 -guile/1.8.8,1 +Gaussian/09-a02,1 +Gaussian/09-d01,1 +Gaussian/16_rev_c2,1 +Gdk-Pixbuf/2.42.10-GCCcore-12.2.0,1 +Gdk-Pixbuf/2.42.6-GCCcore-10.3.0,1 +Gdk-Pixbuf/2.42.8-GCCcore-11.3.0,1 +Ghostscript/9.53.3-GCCcore-10.2.0,1 +Ghostscript/9.54.0-GCCcore-10.3.0,1 +GlobalArrays/5.8-intel-2020b,1 +GlobalArrays/5.8-intel-2021a,1 +GlobalArrays/5.8.1-intel-2022a,1 +Go/1.13.5,1 +Go/1.17.3,1 +Go/1.17.6,1 +Go/1.18.1,1 +Graphene/1.10.8-GCCcore-12.2.0,1 Guile/1.8.8-GCCcore-9.3.0,1 -gzip/1.10-GCCcore-10.2.0,1 -gzip/1.10-GCCcore-10.3.0,1 -gzip/1.10-GCCcore-11.2.0,1 -gzip/1.10-GCCcore-9.3.0,1 -gzip/1.12-GCCcore-11.3.0,1 -gzip/1.12-GCCcore-12.2.0,1 -h5py/3.1.0-fosscuda-2020b,1 -h5py/3.1.0-intel-2020b,1 -h5py/3.2.1-foss-2021a,1 -h5py/3.6.0-foss-2021b,1 -h5py/3.6.0-intel-2021b,1 -h5py/3.7.0-foss-2022a,1 -HarfBuzz/2.6.4-GCCcore-9.3.0,1 -HarfBuzz/2.6.7-GCCcore-10.2.0,1 -HarfBuzz/2.8.1-GCCcore-10.3.0,1 -HarfBuzz/2.8.2-GCCcore-11.2.0,1 -HarfBuzz/4.2.1-GCCcore-11.3.0,1 -HarfBuzz/5.3.1-GCCcore-12.2.0,1 HDF/4.2.15-GCCcore-10.2.0,1 HDF/4.2.15-GCCcore-10.3.0,1 HDF5/1.10.6-foss-2020b-parallel,1 @@ -663,43 +426,27 @@ HDF5/1.10.7-gompi-2021a,1 HDF5/1.10.7-gompic-2020b,1 HDF5/1.10.7-iimpi-2020b,1 HDF5/1.10.7-iimpi-2021a,1 +HDF5/1.12.1-NVHPC-21.11,1 +HDF5/1.12.1-NVHPC-21.9,1 +HDF5/1.12.1-NVHPC-22.2,1 HDF5/1.12.1-foss-2021b-parallel,1 HDF5/1.12.1-gompi-2021a,1 HDF5/1.12.1-gompi-2021b,1 HDF5/1.12.1-iimpi-2021b,1 HDF5/1.12.1-intel-2021b-parallel,1 -HDF5/1.12.1-NVHPC-21.11,1 -HDF5/1.12.1-NVHPC-21.9,1 -HDF5/1.12.1-NVHPC-22.2,1 HDF5/1.12.2-gompi-2022a,1 HDF5/1.12.2-iimpi-2022a,1 HDF5/1.14.0-gompi-2022b,1 HDF5/1.14.0-iimpi-2022b,1 -help2man/1.47.12-GCCcore-9.3.0,1 -help2man/1.47.16-GCCcore-10.2.0,1 -help2man/1.47.4,1 -help2man/1.47.8-GCCcore-8.3.0,1 -help2man/1.48.3-GCCcore-10.3.0,1 -help2man/1.48.3-GCCcore-11.2.0,1 -help2man/1.49.2-GCCcore-11.3.0,1 -help2man/1.49.2-GCCcore-12.1.0,1 -help2man/1.49.2-GCCcore-12.2.0,1 HH-suite/3.3.0-gompic-2020b,1 -hipify-clang/4.2.0-gcccuda-2020b,1 -hipSYCL/0.9.1-GCC-10.2.0,1 -hipSYCL/0.9.1-gcccuda-2020b,1 -hipSYCL/0.9.2-gcccuda-2020b,1 HMMER/3.3.2-gompic-2020b,1 +HarfBuzz/2.6.4-GCCcore-9.3.0,1 +HarfBuzz/2.6.7-GCCcore-10.2.0,1 +HarfBuzz/2.8.1-GCCcore-10.3.0,1 +HarfBuzz/2.8.2-GCCcore-11.2.0,1 +HarfBuzz/4.2.1-GCCcore-11.3.0,1 +HarfBuzz/5.3.1-GCCcore-12.2.0,1 Horovod/0.27.0-foss-2021b-CUDA-11.4.1-TensorFlow-2.8.4,1 -htop/3.2.1,1 -hwloc/1.11.7-GCC-6.3.0-2.27,1 -hwloc/2.2.0-GCCcore-10.2.0,1 -hwloc/2.2.0-GCCcore-9.3.0,1 -hwloc/2.4.1-AOCL-3.0.1-AOCC-3.1.0,1 -hwloc/2.4.1-GCCcore-10.3.0,1 -hwloc/2.5.0-GCCcore-11.2.0,1 -hwloc/2.7.1-GCCcore-11.3.0,1 -hwloc/2.8.0-GCCcore-12.2.0,1 HyperQueue/0.10.0,1 HyperQueue/0.11.0,1 HyperQueue/0.12.0,1 @@ -707,74 +454,961 @@ HyperQueue/0.13.0,1 HyperQueue/0.14.0,1 HyperQueue/0.15.0,1 HyperQueue/0.9.0,1 -hypothesis/5.41.2-GCCcore-10.2.0,1 -hypothesis/5.41.5-GCCcore-10.2.0,1 -hypothesis/6.13.1-GCC-10.2.0,1 -hypothesis/6.13.1-GCCcore-10.3.0,1 -hypothesis/6.14.6-GCCcore-10.2.0,1 -hypothesis/6.14.6-GCCcore-11.2.0,1 -hypothesis/6.46.7-GCCcore-11.3.0,1 -hypothesis/6.68.2-GCCcore-12.2.0,1 Hypre/2.20.0-intel-2020b,1 Hypre/2.21.0-foss-2021a,1 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+impi/2018.4.274-iccifort-2018.5.274-GCC-8.3.0-2.32,1 +impi/2018.4.274-iccifort-2019.1.144-GCC-8.2.0-2.31.1,1 +impi/2019.9.304-iccifort-2020.1.217,1 +impi/2019.9.304-iccifort-2020.4.304,1 +impi/2021.2.0-intel-compilers-2021.2.0,1 +impi/2021.4.0-intel-compilers-2021.4.0,1 +impi/2021.5.0-intel-compilers-2022.0.1,1 +impi/2021.6.0-intel-compilers-2022.1.0,1 impi/2021.7.1-intel-compilers-2022.2.1,1 -Inspector/2019_update5,1 +intel-compilers/2021.2.0,1 +intel-compilers/2021.4.0,1 +intel-compilers/2022.0.1,1 +intel-compilers/2022.1.0,1 +intel-compilers/2022.2.1,1 intel/2017c,1 intel/2018a,1 intel/2019a,1 @@ -785,11 +1419,6 @@ intel/2021b,1 intel/2022.00,1 intel/2022a,1 intel/2022b,1 -intel-compilers/2021.2.0,1 -intel-compilers/2021.4.0,1 -intel-compilers/2022.0.1,1 -intel-compilers/2022.1.0,1 -intel-compilers/2022.2.1,1 intltool/0.51.0,1 intltool/0.51.0-GCCcore-10.2.0,1 intltool/0.51.0-GCCcore-10.3.0,1 @@ -800,22 +1429,9 @@ intltool/0.51.0-GCCcore-12.2.0,1 intltool/0.51.0-GCCcore-9.3.0,1 iomkl/2020b,1 iompi/2020b,1 -IOR/3.3.0-gompi-2022a,1 -IOTK/1.2.2-intel-2020a,1 ipp/2020.3.304,1 irodsfs/0.7.6,1 itac/2020.3.036,1 -JANPA/V2.03-pre-release,1 -JasPer/2.0.24-GCCcore-10.2.0,1 -JasPer/2.0.28-GCCcore-10.3.0,1 -JasPer/2.0.33-GCCcore-11.2.0,1 -JasPer/2.0.33-GCCcore-11.3.0,1 -JasPer/4.0.0-GCCcore-12.2.0,1 -Java/11.0.2,1 -Java/11(@Java/11.0.2),1 -Java/13.0.2,1 -Java/13(@Java/13.0.2),1 -Java/1.8.0_221,1 jax/0.2.19-fosscuda-2020b,1 jbigkit/2.1-GCCcore-10.3.0,1 jbigkit/2.1-GCCcore-11.2.0,1 @@ -823,29 +1439,14 @@ jbigkit/2.1-GCCcore-11.3.0,1 jbigkit/2.1-GCCcore-12.2.0,1 jbigkit/2.1-GCCcore-9.3.0,1 jemalloc/5.2.1-GCCcore-10.2.0,1 -JOE/4.6,1 -JsonCpp/1.9.4-GCCcore-10.2.0,1 -JsonCpp/1.9.4-GCCcore-10.3.0,1 -JsonCpp/1.9.4-GCCcore-11.2.0,1 -JsonCpp/1.9.5-GCCcore-11.3.0,1 -Julia/1.5.3-linux-x86_64,1 -Julia/1.8.3-linux-x86_64,1 -Julia/1.8.5-linux-x86_64,1 -JUnit/4.13.2-Java-13,1 -KaHIP/3.14-gompi-2022b,1 -KaHIP/3.14-iimpi-2022b,1 -Kalign/3.3.1-GCCcore-10.2.0,1 -KAROLINA/FAKEintel,1 -Kerberos/1.20,1 -LAME/3.100,1 -LAME/3.100-GCCcore-10.2.0,1 -LAME/3.100-GCCcore-10.3.0,1 -LAME/3.100-GCCcore-11.3.0,1 -LAME/3.100-GCCcore-12.2.0,1 -LAMMPS/20201029-intel-2020a,1 -LAPACK/3.10.0-GCC-11.2.0,1 -LAPACK/3.10.0-gompi-2021a,1 -LAPACK/3.9.1-GCC-10.2.0,1 +libFLAME/5.2.0-GCCcore-10.2.0,1 +libGLU/9.0.1-GCCcore-10.2.0,1 +libGLU/9.0.1-GCCcore-10.3.0,1 +libGLU/9.0.2-GCCcore-11.2.0,1 +libGLU/9.0.2-GCCcore-11.3.0,1 +libGLU/9.0.2-GCCcore-12.2.0,1 +libGridXC/0.8.5-iimpi-2020b,1 +libPSML/1.1.8-iccifort-2020.4.304,1 libarchive/3.4.2-GCCcore-9.3.0,1 libarchive/3.4.3,1 libarchive/3.4.3-GCCcore-10.2.0,1 @@ -893,7 +1494,6 @@ libffi/3.3-GCCcore-9.3.0,1 libffi/3.4.2-GCCcore-11.2.0,1 libffi/3.4.2-GCCcore-11.3.0,1 libffi/3.4.4-GCCcore-12.2.0,1 -libFLAME/5.2.0-GCCcore-10.2.0,1 libgd/2.3.0-GCCcore-10.2.0,1 libgd/2.3.1,1 libgd/2.3.1-GCCcore-10.3.0,1 @@ -901,29 +1501,17 @@ libgd/2.3.3-GCCcore-12.2.0,1 libgeotiff/1.6.0-GCCcore-10.2.0,1 libgeotiff/1.6.0-GCCcore-10.3.0,1 libgit2/1.1.0-GCCcore-10.3.0,1 -libGLU/9.0.1-GCCcore-10.2.0,1 -libGLU/9.0.1-GCCcore-10.3.0,1 -libGLU/9.0.2-GCCcore-11.2.0,1 -libGLU/9.0.2-GCCcore-11.3.0,1 -libGLU/9.0.2-GCCcore-12.2.0,1 libglvnd/1.3.2-GCCcore-10.2.0,1 libglvnd/1.3.3-GCCcore-10.3.0,1 libglvnd/1.3.3-GCCcore-11.2.0,1 libglvnd/1.4.0-GCCcore-11.3.0,1 libglvnd/1.6.0-GCCcore-12.2.0,1 libgpuarray/0.7.6-fosscuda-2020b,1 -libGridXC/0.8.5-iimpi-2020b,1 libiconv/1.16-GCCcore-10.2.0,1 libiconv/1.16-GCCcore-10.3.0,1 libiconv/1.16-GCCcore-9.3.0,1 libiconv/1.17-GCCcore-11.3.0,1 libiconv/1.17-GCCcore-12.2.0,1 -Libint2/5-4-3-6-5-4_1-GCC-11.2.0-lmax-5-psi4,1 -Libint2/5-4-3-6-5-4_mm4f12ob2-GCC-11.2.0-lmax-5-psi4,1 -Libint/2.6.0-GCC-10.2.0-lmax-6-cp2k,1 -Libint/2.6.0-GCC-10.3.0-lmax-6-cp2k,1 -Libint/2.6.0-iccifort-2020.4.304-lmax-6-cp2k,1 -Libint/2.7.2-GCC-11.3.0-lmax-6-cp2k,1 libjpeg-turbo/1.5.3,1 libjpeg-turbo/2.0.4-GCCcore-9.3.0,1 libjpeg-turbo/2.0.5-GCCcore-10.2.0,1 @@ -956,24 +1544,18 @@ libpng/1.6.37-GCCcore-11.2.0,1 libpng/1.6.37-GCCcore-11.3.0,1 libpng/1.6.37-GCCcore-9.3.0,1 libpng/1.6.38-GCCcore-12.2.0,1 -libPSML/1.1.8-iccifort-2020.4.304,1 libreadline/6.3,1 libreadline/7.0,1 libreadline/8.0-GCCcore-10.2.0,1 libreadline/8.0-GCCcore-9.3.0,1 -libreadline/8.1.2-GCCcore-11.3.0,1 libreadline/8.1-GCCcore-10.3.0,1 libreadline/8.1-GCCcore-11.2.0,1 +libreadline/8.1.2-GCCcore-11.3.0,1 libreadline/8.2-GCCcore-12.2.0,1 libreoffice/7.4.1.1-GCCcore-11.3.0,1 libsndfile/1.0.28,1 libsndfile/1.0.28-GCCcore-10.2.0,1 libsndfile/1.0.31-GCCcore-10.3.0,1 -LibTIFF/4.1.0-GCCcore-10.2.0,1 -LibTIFF/4.2.0-GCCcore-10.3.0,1 -LibTIFF/4.3.0-GCCcore-11.2.0,1 -LibTIFF/4.3.0-GCCcore-11.3.0,1 -LibTIFF/4.4.0-GCCcore-12.2.0,1 libtirpc/1.3.1-GCCcore-10.2.0,1 libtirpc/1.3.2-GCCcore-10.2.0,1 libtirpc/1.3.2-GCCcore-10.3.0,1 @@ -1033,24 +1615,6 @@ libyaml/0.2.5-GCCcore-10.3.0,1 libyaml/0.2.5-GCCcore-11.2.0,1 libyaml/0.2.5-GCCcore-11.3.0,1 libyaml/0.2.5-GCCcore-12.2.0,1 -LicenseChecker/1.0,1 -LittleCMS/2.11-GCCcore-10.2.0,1 -LittleCMS/2.12-GCCcore-10.3.0,1 -LLVM/10.0.1-GCCcore-10.2.0,1 -LLVM/11.0.0-GCCcore-10.2.0,1 -LLVM/11.1.0-GCCcore-10.3.0,1 -LLVM/12.0.1-GCCcore-11.2.0,1 -LLVM/14.0.3-GCCcore-11.3.0,1 -LLVM/15.0.5-GCCcore-12.2.0,1 -LLVM/9.0.0-GCCcore-8.3.0,1 -LMDB/0.9.24-GCCcore-10.2.0,1 -LMDB/0.9.28-GCCcore-10.3.0,1 -LMDB/0.9.29-GCCcore-11.2.0,1 -LMDB/0.9.29-GCCcore-11.3.0,1 -lmod,1 -Lua/5.4.2-GCCcore-10.2.0,1 -Lua/5.4.3-GCCcore-10.3.0,1 -Lua/5.4.4-GCCcore-12.2.0,1 lxml/4.6.2-GCCcore-10.2.0,1 lxml/4.6.3-GCCcore-10.3.0,1 lxml/4.9.1-GCCcore-11.3.0,1 @@ -1060,17 +1624,6 @@ lz4/1.9.3-GCCcore-10.3.0,1 lz4/1.9.3-GCCcore-11.2.0,1 lz4/1.9.3-GCCcore-11.3.0,1 lz4/1.9.4-GCCcore-12.2.0,1 -M4/1.4.18,1 -M4/1.4.18-GCCcore-10.2.0,1 -M4/1.4.18-GCCcore-10.3.0,1 -M4/1.4.18-GCCcore-8.2.0,1 -M4/1.4.18-GCCcore-8.3.0,1 -M4/1.4.18-GCCcore-9.3.0,1 -M4/1.4.19,1 -M4/1.4.19-GCCcore-11.2.0,1 -M4/1.4.19-GCCcore-11.3.0,1 -M4/1.4.19-GCCcore-12.1.0,1 -M4/1.4.19-GCCcore-12.2.0,1 maeparser/1.3.0-iimpi-2020a,1 magic/0.4.24-GCCcore-10.2.0-Python-3.8.6,1 magma/2.5.4-fosscuda-2020b,1 @@ -1082,99 +1635,32 @@ make/4.4.1-GCCcore-12.2.0,1 makeinfo/6.7-GCCcore-10.2.0,1 makeinfo/6.7-GCCcore-10.3.0,1 makeinfo/6.7-GCCcore-9.3.0,1 -Mako/1.1.3-GCCcore-10.2.0,1 -Mako/1.1.4-GCCcore-10.3.0,1 -Mako/1.1.4-GCCcore-11.2.0,1 -Mako/1.2.0-GCCcore-11.3.0,1 -Mako/1.2.4-GCCcore-12.2.0,1 -MaSuRCA/4.0.7-foss-2020a-Perl-5.30.2,1 -MATLAB/R2015b,1 -MATLAB/R2021a,1 matplotlib/2.2.5-foss-2020b-Python-2.7.18,1 matplotlib/3.3.3-foss-2020b,1 matplotlib/3.3.3-fosscuda-2020b,1 matplotlib/3.5.2-foss-2022a,1 matplotlib/3.5.2-intel-2022a,1 -MCR/R2015b,1 mctc-lib/0.3.1-GCC-11.2.0,1 mctc-lib/0.3.1-GCCcore-11.3.0,1 -MedeA/3.4.0,1 -Mercurial/6.2-GCCcore-11.3.0,1 -Mesa/20.2.1-GCCcore-10.2.0,1 -Mesa/21.1.1-GCCcore-10.3.0,1 -Mesa/21.1.7-GCCcore-11.2.0,1 -Mesa/22.0.3-GCCcore-11.3.0,1 -Mesa/22.2.4-GCCcore-12.2.0,1 -Meson/0.53.2-GCCcore-9.3.0-Python-3.8.2,1 -Meson/0.55.1-GCCcore-9.3.0-Python-3.8.2,1 -Meson/0.55.3-GCCcore-10.2.0,1 -Meson/0.58.0-GCCcore-10.3.0,1 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mpi4py/3.1.1-gompi-2020b,1 mpi4py/3.1.1-intel-2020b,1 mpi4py/3.1.3-foss-2020b,1 mpi4py/3.1.3-foss-2021a,1 mpi4pyscf/0.3.1-foss-2021a,1 -MPICH/3.3.2-GCC-10.2.0,1 msgpack/1.0.5-GCCcore-11.3.0,1 mstore/0.2.0-GCC-11.2.0,1 mstore/0.2.0-GCCcore-11.3.0,1 -MUMPS/5.3.5-intel-2020b-metis,1 -MUMPS/5.4.0-foss-2021a-metis,1 muParser/2.3.3-GCCcore-10.3.0,1 muparserx/4.0.8-GCCcore-10.3.0,1 -NAMD/2.14-intel-2020a,1 -NAMD/2.14-intel-2020a-mpi,1 -NAMD/2.9-intel-2017c-mpi,1 nano/6.4,1 nano/6.4-GCCcore-11.2.0,1 nano/6.4-GCCcore-11.3.0,1 nano/7.0-GCCcore-11.3.0,1 nano/7.1-GCCcore-12.2.0,1 -NASM/2.13.03,1 -NASM/2.14.02-GCCcore-9.3.0,1 -NASM/2.15.05,1 -NASM/2.15.05-GCCcore-10.2.0,1 -NASM/2.15.05-GCCcore-10.3.0,1 -NASM/2.15.05-GCCcore-11.2.0,1 -NASM/2.15.05-GCCcore-11.3.0,1 -NASM/2.15.05-GCCcore-12.2.0,1 -NCCL/2.10.3-GCCcore-10.3.0-CUDA-11.3.1,1 -NCCL/2.10.3-GCCcore-11.2.0-CUDA-11.4.1,1 -NCCL/2.12.12-GCCcore-11.3.0-CUDA-11.7.0,1 -NCCL/2.12.7-GCC-10.2.0-CUDA-11.6.0,1 -NCCL/2.8.3-GCCcore-10.2.0-CUDA-11.1.1,1 ncurses/6.0,1 ncurses/6.1,1 ncurses/6.2,1 @@ -1185,7 +1671,13 @@ ncurses/6.2-GCCcore-9.3.0,1 ncurses/6.3,1 ncurses/6.3-GCCcore-11.3.0,1 ncurses/6.3-GCCcore-12.2.0,1 -NECI/20220711-foss-2022a,1 +netCDF-Fortran/4.5.2-intel-2020a,1 +netCDF-Fortran/4.5.3-gompi-2020b,1 +netCDF-Fortran/4.5.3-gompic-2020b,1 +netCDF-Fortran/4.5.3-iimpi-2021a,1 +netCDF-Fortran/4.5.3-intel-2020b,1 +netCDF-Fortran/4.6.0-gompi-2022a,1 +netCDF-Fortran/4.6.0-iimpi-2022a,1 netCDF/4.7.3-intel-2020a,1 netCDF/4.7.4-gompi-2020b,1 netCDF/4.7.4-gompic-2020b,1 @@ -1196,196 +1688,44 @@ netCDF/4.8.0-iimpi-2021a,1 netCDF/4.9.0-gompi-2022a,1 netCDF/4.9.0-gompi-2022b,1 netCDF/4.9.0-iimpi-2022a,1 -netCDF-Fortran/4.5.2-intel-2020a,1 -netCDF-Fortran/4.5.3-gompi-2020b,1 -netCDF-Fortran/4.5.3-gompic-2020b,1 -netCDF-Fortran/4.5.3-iimpi-2021a,1 -netCDF-Fortran/4.5.3-intel-2020b,1 -netCDF-Fortran/4.6.0-gompi-2022a,1 -netCDF-Fortran/4.6.0-iimpi-2022a,1 -NetKet/3.3.2.post1-OpenMPI-4.1.1-CUDA-11.6.0,1 nettle/3.4.1,1 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xxd/8.2.4220-GCCcore-11.3.0,1 -XZ/5.2.5,1 -XZ/5.2.5-GCCcore-10.2.0,1 -XZ/5.2.5-GCCcore-10.3.0,1 -XZ/5.2.5-GCCcore-11.2.0,1 -XZ/5.2.5-GCCcore-11.3.0,1 -XZ/5.2.5-GCCcore-9.3.0,1 -XZ/5.2.7-GCCcore-12.2.0,1 -Yambo/5.0.4-intel-2020a,1 -Yambo/5.0.4-intel-2021a,1 -Yambo/5.1.0-intel-2020a,1 -Yasm/1.3.0-GCCcore-10.2.0,1 -Yasm/1.3.0-GCCcore-10.3.0,1 -Yasm/1.3.0-GCCcore-11.3.0,1 -Yasm/1.3.0-GCCcore-12.2.0,1 -Z3/4.10.2-GCCcore-11.3.0,1 -Z3/4.8.10-GCCcore-10.2.0,1 -Z3/4.8.12-GCCcore-11.2.0,1 -Zip/3.0-GCCcore-10.2.0,1 -Zip/3.0-GCCcore-10.3.0,1 -Zip/3.0-GCCcore-11.2.0,1 -Zip/3.0-GCCcore-11.3.0,1 zlib/1.2.11,1 zlib/1.2.11-GCCcore-10.2.0,1 zlib/1.2.11-GCCcore-10.3.0,1 diff --git a/karolina.md b/karolina.md index e9ea9fe2c206bc2b6f7d201551b3b10ea45c5fbe..0c22757894dc3ecb90452a8c6679ac387cfc5ec6 100644 --- a/karolina.md +++ b/karolina.md @@ -1,19 +1,4 @@ -## Core - -| Module | Description | -| ------ | ----------- | - -## Core - -| Module | Description | -| ------ | ----------- | - -## Linux - -| Module | Description | -| ------ | ----------- | - ## Base | Module | Description |