19 Commits

Author SHA1 Message Date
Lukas Krupcik
6aebeeac3d new file: f/Forge/Forge-21.1.3-test.eb
new file:   o/OpenFOAM/OpenFOAM-9-foss-2021a.eb
	modified:   o/OpenMPI/OpenMPI-4.1.2-NVHPC-22.2-CUDA-11.6.0-v2.eb
	modified:   o/OpenMPI/OpenMPI-4.1.2-NVHPC-22.2-CUDA-11.6.0.eb
	new file:   u/UCX/UCX-1.12.0-GCC-10.2.0-CUDA-11.6.0.eb
	new file:   u/UCX/UCX-1.12.0-NVHPC-22.2-CUDA-11.6.0.eb
2022-03-14 18:46:35 +01:00
easybuild
9e65728e88 new file: a/Automake/Automake-1.16.4.eb
new file:   b/BEEF/BEEF-0.1.1-intel-2020b.eb
	deleted:    b/Bison/Bison-3.0.4.eb
	new file:   b/BoltzTraP2/BoltzTraP2-20.7.1-intel-2020b-Python-3.8.6.eb
	new file:   c/CUDAcore/CUDAcore-11.6.0.eb
	new file:   f/Forge/Forge-21.1.3.eb
	deleted:    f/flex/flex-2.6.4.eb
	modified:   g/GROMACS/GROMACS-2020.4-fosscuda-2020b-PLUMED-2.7.0-patch.eb
	deleted:    m/M4/M4-1.4.17.eb
	deleted:    m/M4/M4-1.4.18.eb
	new file:   n/NVHPC/NVHPC-22.2.eb
	new file:   o/Octave/Octave-6.4.0-intel-2020b-without-X11.eb
	new file:   o/OpenMPI/OpenMPI-4.0.6-NVHPC-22.2-CUDA-11.6.0.eb
	new file:   o/OpenMPI/OpenMPI-4.1.2-NVHPC-22.2-CUDA-11.6.0-v2.eb
	new file:   o/OpenMPI/OpenMPI-4.1.2-NVHPC-22.2-CUDA-11.6.0.eb
	new file:   o/OpenSSL/OpenSSL-1.1.eb
	new file:   p/Python/Python-3.9.6-GCCcore-11.2.0-NetKet.eb
	modified:   p/protobuf/protobuf-2.5.0.eb
	new file:   s/Singularity/Singularity-3.8.6.eb
	new file:   u/UCX/UCX-1.11.2-GCC-10.2.0-CUDA-11.6.0.eb
	new file:   u/UCX/UCX-1.11.2-NVHPC-22.2-CUDA-11.6.0.eb
	new file:   v/VTK/VTK-9.1.0-intel-2020b-Python-3.8.6.eb
	deleted:    z/zlib/zlib-1.2.11.eb
2022-03-04 13:15:08 +01:00
Lukas Krupcik
a49b71afca new file: a/AOCC/AOCC-3.2.0-GCCcore-11.2.0.eb
new file:   c/CP2K/CP2K-8.2-foss-2020b.eb
	new file:   c/CP2K/CP2K-8.2-intel-2020b.eb
	modified:   d/DFTB+/DFTB+-21.1-intel-2020b-Python-3.8.6-karolina.eb
	new file:   g/GROMACS/GROMACS-2021.4-fosscuda-2020b-PLUMED-2.7.3.eb
	modified:   g/GROMACS/GROMACS-2021.4-intel-2020b-PLUMED-2.7.2.eb
	new file:   g/GROMACS/GROMACS-2021.4-intel-2020b-PLUMED-2.7.3.eb
	new file:   i/intel-compilers/intel-compilers-2021.4.0.eb
	new file:   l/Libint/Libint-2.6.0-GCC-10.2.0-lmax-6-cp2k.eb
	new file:   l/libxc/libxc-5.1.3-GCC-10.2.0.eb
	modified:   n/NVHPC/NVHPC-21.11.eb
	new file:   o/Octopus/Octopus-11.3-intel-2020b-mpi.eb
	new file:   o/OpenMPI/OpenMPI-4.0.6-NVHPC-21.11-CUDA-11.4.1-v2.eb
	new file:   o/OpenMPI/OpenMPI-4.0.6-NVHPC-21.11-CUDA-11.4.1.eb
	new file:   p/PETSc/PETSc-3.16.2-intel-2020b.eb
	new file:   p/PLUMED/PLUMED-2.7.3-fosscuda-2020b.eb
	new file:   p/phonopy/phonopy-2.12.0-conda.eb
	new file:   u/UCX/UCX-1.11.2-GCCcore-11.2.0.eb
	new file:   u/UCX/UCX-1.11.2-NVHPC-21.11-CUDA-11.4.1.eb
	new file:   v/VASP/VASP-5.4.4-intel-2020a-mkl=sequential-karolina.eb
2022-01-05 09:50:03 +01:00
Lukas Krupcik
465d7a421a new file: g/graphite2/graphite2-1.3.14-GCCcore-10.2.0.eb
new file:   m/magic/magic-0.4.24-GCCcore-10.2.0-Python-3.8.6.eb
	modified:   n/NVHPC/NVHPC-21.9.eb
	new file:   o/OpenMPI/OpenMPI-4.0.7-GCC-10.2.0-UCX-1.11.2-CUDA-11.4.1.eb
	new file:   o/OpenMPI/OpenMPI-4.0.7-GCC-9.3.0-UCX-1.9.0-CUDA-11.4.1.eb
	new file:   p/poppler/poppler-21.06.1-GCC-10.2.0.eb
	new file:   s/s3cmd/s3cmd-2.1.0-GCCcore-10.2.0-Python-3.8.6.eb
	new file:   t/texlive/texlive-20210325-GCCcore-10.2.0.eb
	new file:   u/UCX/UCX-1.11.2-GCC-10.2.0-CUDA-11.4.1.eb
	new file:   u/UCX/UCX-1.9.0-GCC-9.3.0-CUDA-11.4.1.eb
	new file:   u/UCX/UCX-1.9.0-NVHPC-21.9-CUDA-11.4.1.eb
	new file:   u/UCX/UCX-1.9.0-NVHPC-21.9-GCC-9.3.0-CUDA-11.4.1.eb
2021-12-07 11:26:32 +01:00
Jakub Kropacek
73ee681a9a modified: a/ABINIT/ABINIT-9.4.2-intel-2020b.eb
new file:   a/ANSYS/ANSYS-21.2-intel-2020b.eb
	new file:   g/GDRCopy/GDRCopy-2.1-NVHPC-21.9-CUDA-11.4.1.eb
	new file:   g/GDRCopy/GDRCopy-2.3-GCCcore-10.2.0.eb
	new file:   g/GDRCopy/GDRCopy-2.3-NVHPC-21.9-CUDA-11.4.1.eb
	new file:   h/HDF5/HDF5-1.10.7-iimpi-2021a.eb
	new file:   n/NVHPC/NVHPC-21.9.eb
	new file:   o/OpenMPI/OpenMPI-4.0.6-NVHPC-21.9-CUDA-11.4.1.eb
	modified:   q/QMCPACK/QMCPACK-3.11.0-intel-2020b-Python-3.8.6.eb
	new file:   u/UCX/UCX-1.11.2-NVHPC-21.9-CUDA-11.4.1.eb
	deleted:    q/QMCPACK/QMCPACK-3.11.0-intel-2020a-Python-3.8.2-test.eb
	deleted:    q/QMCPACK/QMCPACK-3.11.0-intel-2020a-Python-3.8.2.eb
	deleted:    q/QMCPACK/QMCPACK-3.11.0-intel-2020b-Python-3.8.6-test.eb
2021-10-13 19:53:53 +02:00
Lukas Krupcik
9472568c90 deleted: u/UCX/: 2021-08-10 07:45:51 +02:00
Lukas Krupcik
9ed2fc9cb2 Merge branch 'it4i-barbora' 2021-08-09 08:32:32 +02:00
Lukas Krupcik
1f2c7b3d95 new file: b/BerkeleyGW/BerkeleyGW-3.0.1-intel-2020b-Python-3.8.6.eb
new file:   g/GDAL/GDAL-3.3.1-foss-2021a.eb
	new file:   g/GDRCopy/GDRCopy-2.1-GCCcore-9.3.0-CUDA-11.2.2.eb
	new file:   g/GDRCopy/GDRCopy-2.2-NVHPC-21.2-CUDA-11.2.2.eb
	new file:   j/JUBE/JUBE-2.4.1.eb
	new file:   o/ORCA/ORCA-5.0.0-OpenMPI-4.1.1.eb
	new file:   o/ORCA/ORCA-5.0.1-OpenMPI-4.1.1.eb
	new file:   o/OpenMPI/OpenMPI-4.0.5-GCCcore-9.3.0-CUDA-11.2.2-devel.eb
	new file:   o/OpenMPI/OpenMPI-4.0.5-GCCcore-9.3.0-CUDA-11.2.2.eb
	new file:   o/OpenMPI/OpenMPI-4.0.5-NVHPC-21.2-CUDA-11.2.2-UCX-11.1.0-rc2.eb
	new file:   o/OpenMPI/OpenMPI-4.0.5-NVHPC-21.2-CUDA-11.2.2-test.eb
	new file:   o/OpenMPI/OpenMPI-4.0.6-NVHPC-21.2-CUDA-11.2.2.eb
	new file:   s/Schrodinger/Schrodinger_2021-3_Linux-x86_64.eb
	new file:   s/spirit/spirit-2.1.1-CUDA-10.2.89.eb
	new file:   t/Trim_Galore/Trim_Galore-0.6.6-GCC-10.2.0-Python-2.7.18.eb
	new file:   u/UCX/:
	new file:   u/UCX/UCX-1.11.0-rc1-NVHPC-21.2-CUDA-11.2.2.eb
	new file:   u/UCX/UCX-1.9.0-GCCcore-9.3.0-CUDA-11.2.2-devel.eb
	new file:   u/UCX/UCX-1.9.0-GCCcore-9.3.0-CUDA-11.2.2.eb
	modified:   u/UCX/UCX-1.9.0-NVHPC-21.2-CUDA-11.2.2.eb
	new file:   u/UCX/UCX-1.9.0-m4.patch
	new file:   v/VASP/VASP-6.2.1-intel-2020b-mkl=sequential.eb
	new file:   y/Yambo/Yambo-5.0.3-intel-2020a.eb
2021-08-09 08:31:32 +02:00
easybuild
9dde6530b9 add karolina 2021-07-02 11:52:11 +02:00
Lukas Krupcik
e995329acc new file: a/ANSYS/ANSYS-21.1-intel-2018a.eb
new file:   b/Bison/Bison-3.7.6-GCCcore-10.2.0.eb
	new file:   b/bwidget/bwidget-1.9.14-GCCcore-10.2.0.eb
	new file:   d/DFTB+/DFTB+-21.1-intel-2020a-Python-3.8.2.eb
	new file:   g/GDRCopy/GDRCopy-2.1-NVHPC-21.2-CUDA-11.2.0.eb
	new file:   g/GDRCopy/GDRCopy-2.1-NVHPC-21.2-CUDA-11.2.2.eb
	new file:   g/GDRCopy/GDRCopy-2.1-NVHPC-21.2-CUDA-11.3.0.eb
	new file:   g/git/git-2.31.1.eb
	new file:   m/MATLAB/MATLAB-2021a.eb
	new file:   m/Molpro/Molpro-mpp-2021.1.0.linux_x86_64_openmp.eb
	new file:   o/OpenMPI/OpenMPI-4.0.5-NVHPC-21.2-CUDA-11.2.2.eb
	new file:   o/OpenMPI/OpenMPI-4.0.5-NVHPC-21.2-CUDA-11.3.0.eb
	new file:   "o/OpenMPI/\\"
	new file:   s/SoX/SoX-14.4.2-intel-2020b.eb
	modified:   s/SoX/SoX-14.4.2.eb
	new file:   t/Tcl/Tcl-8.6.11-GCCcore-10.2.0.eb
	new file:   t/Tk/Tk-8.6.11-GCCcore-10.2.0.eb
	new file:   t/Togl/Togl-2.0-GCCcore-10.2.0.eb
	new file:   t/Togl/Togl-2.0_configure.patch
	new file:   t/Togl/Togl-2.0_decl.patch
	new file:   u/UCX/UCX-1.10.1-NVHPC-21.2-CUDA-11.3.0.eb
	new file:   u/UCX/UCX-1.9.0-NVHPC-21.2-CUDA-11.2.2.eb
	new file:   u/UCX/UCX-1.9.0-NVHPC-21.2-CUDA-11.3.0.eb
	new file:   x/XCrySDen/XCrySDen-1.6.2-intel-2020b.eb
2021-06-02 10:16:23 +02:00
Lukas Krupcik
d4363d6166 new file: o/OpenMPI/OpenMPI-4.0.5-NVHPC-21.2-test.eb
modified:   o/OpenMPI/OpenMPI-4.0.5-NVHPC-21.2.eb
	new file:   u/UCX/UCX-1.9.0-NVHPC-21.2.eb
	new file:   u/UCX/UCX-1.9.0.patch
2021-03-31 08:57:32 +02:00
Lukáš Krupčík
437d2b2cdd new file: a/Anaconda3/Anaconda3-2020.11.eb
new file:   a/Automake/Automake-1.16.2-GCCcore-9.3.0.eb
	new file:   a/Autotools/Autotools-20200321-GCCcore-9.3.0.eb
	new file:   l/libevent/libevent-2.1.12-GCCcore-9.3.0.eb
	new file:   n/NVHPC/NVHPC-21.2-OpenMPI-4.0.5.eb
	new file:   n/NVHPC/NVHPC-21.2.eb
	new file:   o/OpenMPI/OpenMPI-4.0.5-GCC-10.2.0-Java-13.0.1.eb
	new file:   o/OpenMPI/OpenMPI-4.0.5-NVHPC-21.2.eb
	new file:   p/phono3py/phono3py-1.22.2-conda.eb
	new file:   u/UCX/UCX-1.9.0-GCCcore-9.3.0.eb
2021-03-18 08:07:12 +01:00
Lukáš Krupčík
d748f3b854 modified: c/CheMPS2/CheMPS2-1.8.9-intel-2020a.eb
new file:   d/deepdiff/deepdiff-4.0.6-GCCcore-9.3.0-Python-3.8.2.eb
	modified:   h/HDF5/HDF5-1.10.6-intel-2020a-parallel.eb
	new file:   h/h5py/h5py-2.10.0-intel-2020a.eb
	new file:   i/iccifort/iccifort-2020.1.217.eb
	new file:   i/iimpi/iimpi-2020a.eb.old
	new file:   i/intel/intel-2020a.eb.old
	modified:   l/libxc/libxc-4.3.4-intel-2020a.eb
	modified:   m/METIS/METIS-5.1.0-intel-2020a.eb
	modified:   m/Molden/Molden-6.3-intel-2020a.eb
	modified:   n/netCDF/netCDF-4.7.3-intel-2020a.eb
	new file:   n/networkx/networkx-2.4-intel-2020a-Python-3.8.2.eb
	new file:   o/OpenFOAM/OpenFOAM-v2006-intel-2020a.eb
	modified:   p/PETSc/PETSc-3.12.4-intel-2020a.eb
	new file:   p/PSI4/PSI4-1.3.2-intel-2020a-Py-3.8.2.eb
	new file:   p/pytest/pytest-6.0.1-Python-3.7.8.eb
	new file:   p/pytest/pytest-6.0.1-Python-3.8.2.eb
	modified:   q/QMCPACK/QMCPACK-3.9.1-intel-2020a.eb
	modified:   r/RELION/RELION-3.1.0-intel-2020a.eb
	modified:   s/SCOTCH/SCOTCH-6.0.9-foss-2020a.eb
	new file:   s/SciPy-bundle/SciPy-bundle-2020.03-intel-2020a-Python-3.7.8.eb
	modified:   s/Score-P/Score-P-6.0-intel-2020a.eb
	modified:   s/SuiteSparse/SuiteSparse-5.6.0-intel-2020a-METIS-5.1.0.eb
	new file:   u/UCX/UCX-1.8.0-GCCcore-9.3.0.eb
	new file:   v/VTK/VTK-8.2.0-intel-2020a-Python-3.7.8.eb
	deleted:    i/iimpi/iimpi-2020a.eb
	deleted:    i/intel/intel-2020a.eb
	deleted:    u/UCX/UCX-1.8.1-GCC-9.3.0.eb
	deleted:    u/UCX/UCX-1.8.1-GCCcore-8.3.0.eb
	deleted:    v/VTK/VTK-8.2.0-intel-2020a-Py-3.7.eb
2020-08-21 13:44:21 +02:00
Lukáš Krupčík
6652be5cc5 new file: l/LLVM/LLVM-6.0.0-GCC-6.3.0-2.27.eb
new file:   m/Mako/Mako-1.1.2-Python-3.6.6-foss-2018a.eb
	new file:   m/Mesa/Mesa-18.1.1-foss-2018a.eb
	new file:   o/OpenMPI/OpenMPI-4.0.4-GCC-9.3.0-without-verbs.eb
	modified:   o/OpenMPI/OpenMPI-4.0.4-GCC-9.3.0.eb
	new file:   o/OpenMPI/OpenMPI-4.0.4-GCCcore-8.3.0.eb
	new file:   u/UCX/UCX-1.8.1-GCCcore-8.3.0.eb
	modified:   v/VTK/VTK-8.1.0-foss-2018a-Python-3.6.6.eb
	deleted:    m/Mako/Mako-1.1.2-Python-3.6.6.eb
2020-08-14 08:03:45 +02:00
Lukáš Krupčík
fb28430d8c new file: m/Mesa/Mesa-19.0.1-GCCcore-9.3.0.eb
new file:   n/nettle/nettle-3.5.1-GCCcore-8.3.0.eb
	new file:   u/UCX/UCX-1.8.0_fix-undefined-symbol.patch
	modified:   u/UCX/UCX-1.8.1-GCC-9.3.0.eb
2020-07-30 13:44:42 +02:00
Lukáš Krupčík
013a82b887 new file: h/hwloc/hwloc-2.0.3-GCC-9.3.0.eb
new file:   n/numactl/numactl-2.0.12-GCC-9.3.0.eb
	new file:   o/OpenMPI/OpenMPI-4.0.4-GCC-9.3.0.eb
	new file:   u/UCX/UCX-1.6.1-GCC-9.3.0.eb
	new file:   u/UCX/UCX-1.8.1-GCC-9.3.0.eb
2020-07-30 10:33:39 +02:00
Lukáš Krupčík
f45b93d7f2 modified: o/OpenMPI/OpenMPI-4.0.4-GCC-8.3.0-2.32-CUDA.eb
new file:   u/UCX/UCX-1.6.1-GCCcore-8.3.0-CUDA.eb
2020-07-03 09:45:49 +02:00
Lukáš Krupčík
0855a56183 new file: h/hwloc/hwloc-1.11.12.eb
modified:   l/Libmsr/Libsmr-master-20191216.eb
	new file:   l/libpciaccess/libpciaccess-0.14.eb
	new file:   n/numactl/numactl-2.0.12.eb
	new file:   o/OpenMPI/OpenMPI-3.1.5.eb
	new file:   u/UCX/UCX-1.6.1.eb
2019-12-18 14:40:55 +01:00
Lukáš Krupčík
358a0b44da new file: h/hwloc/hwloc-1.11.12-GCCcore-8.3.0.eb
new file:   h/hwloc/hwloc-2.0.3-GCC-8.3.0-2.32.eb
	modified:   i/impi/impi-2018.4.274-iccifort-2018.5.274-GCC-8.3.0-2.32.eb
	modified:   i/impi/impi-2018.5.288-iccifort-2019.5.281-GCC-8.3.0-2.32.eb
	modified:   i/impi/impi-2019.6.154-iccifort-2019.5.281-GCC-8.3.0-2.32.eb
	new file:   n/numactl/numactl-2.0.12-GCCcore-6.3.0.eb
	modified:   n/numactl/numactl-2.0.12-GCCcore-8.3.0.eb
	modified:   o/OpenMPI/OpenMPI-2.1.5-GCC-6.3.0-2.27.eb
	modified:   o/OpenMPI/OpenMPI-2.1.5-GCC-8.3.0-2.32.eb
	modified:   o/OpenMPI/OpenMPI-3.1.4-GCC-6.3.0-2.27.eb
	new file:   o/OpenMPI/OpenMPI-3.1.4-GCC-8.3.0-2.32.eb
	new file:   o/OpenMPI/OpenMPI-3.1.5-GCCcore-8.3.0.eb
	new file:   o/OpenMPI/OpenMPI-4.0.2-GCC-8.3.0-2.32.eb
	new file:   u/UCX/UCX-1.6.1-GCCcore-6.3.0.eb
	new file:   u/UCX/UCX-1.6.1-GCCcore-8.3.0.eb
	new file:   x/XZ/XZ-5.2.4-GCCcore-8.3.0.eb
	new file:   x/xorg-macros/xorg-macros-1.19.2-GCCcore-8.3.0.eb
2019-12-11 11:05:16 +01:00