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180 Commits

Author SHA1 Message Date
Lukas Krupcik
8db463ed41 new file: c/CGAL/CGAL-5.2-gompi-2020b.eb 
new file:   c/CGAL/CGAL-5.2-iimpi-2020b.eb
	new file:   g/gnuplot/gnuplot-5.4.1-GCCcore-10.2.0.eb
	new file:   h/HDF5/HDF5-1.10.7-iimpi-2020b.eb
	new file:   m/Mako/Mako-1.1.3-GCCcore-10.2.0.eb
	modified:   o/OpenFOAM/OpenFOAM-v2106-foss-2020b.eb
	new file:   o/OpenFOAM/OpenFOAM-v2106-intel-2020b.eb
	new file:   p/ParaView/ParaView-5.9.1-intel-2020b-mpi.eb
	new file:   q/Qt5/Qt5-5.14.2-GCCcore-10.2.0.eb
	new file:   s/SciPy-bundle/SciPy-bundle-2020.11-intel-2020b.eb
	modified:   s/SciPy-bundle/SciPy-bundle-2021.05-intel-2020b.eb
 2021-08-31 14:20:56 +02:00
Lukas Krupcik
123e29051e modified: a/AOCL/AOCL-3.0-6-GCCcore-10.2.0.eb 
new file:   e/ELSI/ELSI-2.5.0-intel-2020b.eb
	new file:   f/FFTW/FFTW-3.3.8-gompi-2020a-amd.eb
	new file:   l/libGridXC/libGridXC-0.8.5-iimpi-2020b.eb
	new file:   l/libPSML/libPSML-1.1.8-iccifort-2020.4.304.eb
	new file:   l/libxc/libxc-4.3.4-intel-2020b.eb
	new file:   p/PETSc/PETSc-3.12.4-intel-2020b.eb
	new file:   s/SLEPc/SLEPc-3.13.3-intel-2020a-Python-3.8.6.eb
	new file:   s/Siesta/Siesta-4.1-Max-1.2.0-intel-2020b.eb
	new file:   s/Siesta/Siesta-4.1-b5-intel-2020b-test.eb
	new file:   t/TotalView/TotalView-2021.2.14.eb
	new file:   x/xmlf90/xmlf90-1.5.4-iccifort-2020.4.304.eb
 2021-08-16 08:54:09 +02:00
Lukas Krupcik
70f887ce13 new file: s/Siesta/Siesta-4.1-b4-intel-2020b.eb 
new file:   s/Siesta/Siesta-4.1-b5-intel-2020b.eb
	deleted:    s/Siesta/Siesta-4.1.5-intel-2020b.eb
 2021-08-10 07:37:28 +02:00
Lukas Krupcik
58dddb69c6 modified: h/HDF5/HDF5-1.10.6-intel-2020a.eb 
new file:   n/netCDF/netCDF-4.7.4-intel-2020b.eb
	new file:   s/Siesta/Siesta-4.1.5-intel-2020b.eb
 2021-08-09 10:59:17 +02:00
Lukas Krupcik
5413865e74 Merge branch 'it4i-salomon' 2021-08-09 08:32:32 +02:00
Lukas Krupcik
67fe6cb595 new file: m/magic/magic-0.4.24-GCCcore-9.3.0-Python-3.8.2.eb 
new file:   s/s3cmd/s3cmd-2.1.0-GCCcore-9.3.0-Python-3.8.2.eb
 2021-08-09 08:31:55 +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
Lukas Krupcik
705e6c3773 new file: s/Singularity/Singularity-3.8.0.eb 2021-06-16 10:56:37 +02:00
Lukas Krupcik
747221f326 new file: a/arpack-ng/arpack-ng-3.8.0-intel-2020b.eb 
new file:   b/BerkeleyGW/BerkeleyGW-2.1.0-intel-2020b-Python-3.8.6.eb
	new file:   b/BerkeleyGW/BerkeleyGW-2.1.0_missing_file.patch
	new file:   b/BerkeleyGW/BerkeleyGW-2.1.0_tests.patch
	new file:   d/DFTB+/DFTB+-21.1-intel-2020b-Python-3.8.6.eb
	new file:   d/DFTB+/config.cmake-MANUAL-INSTALATION.patch
	new file:   d/dftd3-lib/dftd3-lib-0.9.2-GCC-10.2.0.eb
	new file:   d/dftd3-lib/dftd3-lib-0.9.2_fix-extras-syntax.patch
	new file:   e/ELPA/ELPA-2019.11.001-intel-2020b.eb
	new file:   h/HDF5/HDF5-1.10.6-iimpi-2020b.eb
	new file:   h/h5py/h5py-2.10.0-intel-2020b-Python-3.8.6.eb
	new file:   h/hypothesis/hypothesis-6.13.1-GCC-10.2.0.eb
	new file:   i/impi/impi-2021.2.0-intel-compilers-2021.2.0.eb
	new file:   i/intel-compilers/intel-compilers-2021.2.0.eb
	new file:   n/Newton-X/Newton-X-2.2-B09-intel-2020b.eb
	new file:   n/Newton-X/newton-x-2.2.patch
	new file:   p/pkgconfig/pkgconfig-1.5.1-GCCcore-10.2.0-python.eb
	new file:   p/pybind11/pybind11-2.4.3-GCC-10.2.0-Python-3.8.6.eb
	new file:   p/pybind11/pybind11-2.6.0-GCC-10.2.0-Python-3.8.6.eb
	new file:   s/Schrodinger/Schrodinger_2021-2_Linux-x86_64.eb
	new file:   s/SciPy-bundle/SciPy-bundle-2020.03-intel-2020b-Python-3.8.6.eb
	new file:   s/SciPy-bundle/SciPy-bundle-2021.05-intel-2020b.eb
 2021-06-16 07:42:30 +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
35c211a68e new file: g/Graphviz/Graphviz-2.44.1-GCCcore-9.3.0-Java-11-Python-3.8.2.eb 
new file:   g/Graphviz/Graphviz-2.44.1-GCCcore-9.3.0-Java-11.eb
	new file:   h/h5py/h5py-2.9.0-GCC-9.3.0-Python-3.8.6.eb
	new file:   h/h5py/h5py-3.1.0-intel-2020a-Python-3.8.6.eb
	new file:   m/mpi4py/mpi4py-3.0.1-intel-2020a-Python-3.8.6.eb
	new file:   p/PyQt5/PyQt5-5.13.1-GCC-9.3.0-Python-3.8.6.eb
	new file:   p/PyQt5/PyQt5-5.14.1-GCC-9.3.0-Python-3.8.6.eb
	new file:   p/PyQt5/PyQt5-5.15.1-GCCcore-9.3.0-Python-3.8.2.eb
	new file:   p/PyQt5/PyQt5-5.15.1-GCCcore-9.3.0.eb
	new file:   p/pkgconfig/pkgconfig-1.5.1-GCCcore-9.3.0-Python-3.8.6.eb
	new file:   p/pybind11/pybind11-2.4.3-GCCcore-9.3.0-Python-3.8.6.eb
	new file:   s/SciPy-bundle/SciPy-bundle-2020.03-intel-2020a-Python-3.8.6.eb
 2021-03-03 12:50:06 +01:00
Lukáš Krupčík
e763df4c4a new file: a/ASE/ASE-3.21.1-Py-3.7.eb 
new file:   a/ASE/ASE-3.21.1-intel-2020a.eb
	new file:   c/CMake/CMake-3.18.4-GCCcore-9.3.0.eb
	new file:   c/cURL/cURL-7.72.0-GCCcore-9.3.0.eb
	new file:   e/Eigen/Eigen-3.3.8-GCCcore-9.3.0.eb
	new file:   f/freetype/freetype-2.10.3-GCCcore-9.3.0.eb
	new file:   g/GPAW-setups/GPAW-setups-0.9.20000.eb
	new file:   g/GPAW/GPAW-21.1.0-intel-2020a-ASE-3.21.1.eb
	new file:   g/GPAW/GPAW-21.1.0-intel-2020a-Py-3.7.eb
	new file:   h/hypothesis/hypothesis-5.41.2-GCCcore-9.3.0.eb
	new file:   i/iccifort/iccifort-2020.4.304.eb
	new file:   l/libarchive/libarchive-3.4.3-GCCcore-9.3.0.eb
	new file:   l/libjpeg-turbo/libjpeg-turbo-2.0.5-GCCcore-9.3.0.eb
	new file:   m/matplotlib/matplotlib-3.3.3-intel-2020a.eb
	new file:   n/NASM/NASM-2.15.05-GCCcore-9.3.0.eb
	new file:   o/OpenMPI/OpenMPI-4.0.5-GCC-10.2.0.eb
	new file:   p/Pillow/Pillow-8.0.1-GCCcore-9.3.0.eb
	new file:   p/Python/Python-3.8.6-GCCcore-9.3.0.eb
	new file:   p/pybind11/pybind11-2.6.0-GCCcore-9.3.0.eb
	new file:   s/SQLite/SQLite-3.33.0-GCCcore-9.3.0.eb
	new file:   s/SciPy-bundle/SciPy-bundle-2020.11-intel-2020a.eb
	new file:   s/spglib-python/spglib-python-1.16.0-intel-2020a.eb
	new file:   t/Tkinter/Tkinter-3.8.6-GCCcore-9.3.0.eb
 2021-02-10 11:53:17 +01:00
Lukáš Krupčík
30e6b5dbe8 modified: .gitignore 
deleted:    s/SciPy-bundle/SciPy-bundle.dot
 2020-12-21 12:11:45 +01:00
Lukáš Krupčík
8a85cb973c new file: s/SciPy-bundle/SciPy-bundle.dot 2020-12-17 08:58:31 +01:00
Lukáš Krupčík
0e590e5f04 modified: s/Singularity/Singularity-3.7.0.eb 2020-12-15 10:32:17 +01:00
Lukáš Krupčík
c13ec628c7 new file: s/Singularity/Singularity-3.7.0.eb 2020-12-15 10:29:19 +01:00
Lukáš Krupčík
85d4d8a104 new file: s/Singularity/Singularity-3.6.4.eb 
deleted:    s/Singularity/Singularity-3.6.2.eb
 2020-10-20 08:46:27 +02:00
Lukáš Krupčík
6c3f5984fa new file: s/Singularity/Singularity-3.6.3.eb 2020-09-30 08:46:23 +02:00
Lukáš Krupčík
fb9cb20ea7 deleted: "s/Singularity/\\" 2020-09-15 10:25:00 +02:00
Lukáš Krupčík
806e689d55 modified: s/Singularity/Singularity-3.6.2.eb 
new file:   "s/Singularity/\\"
	deleted:    s/Singularity/Singularity-2.2-GCC-6.3.0-2.27.eb
	deleted:    s/Singularity/Singularity-2.2.1-GCC-6.3.0-2.27.eb
	deleted:    s/Singularity/Singularity-2.2.99-GCC-6.3.0-2.27-develop.eb
	deleted:    s/Singularity/Singularity-2.3-develop.eb
	deleted:    s/Singularity/Singularity-2.3.1.eb
	deleted:    s/Singularity/Singularity-2.3.2-docker-fix.eb
	deleted:    s/Singularity/Singularity-2.3.2.eb
	deleted:    s/Singularity/Singularity-2.3.eb
	deleted:    s/Singularity/Singularity-2.4.1.eb
	deleted:    s/Singularity/Singularity-2.4.2.eb
	deleted:    s/Singularity/Singularity-2.4.4-build.patch
	deleted:    s/Singularity/Singularity-2.4.4-functions.patch
	deleted:    s/Singularity/Singularity-2.4.4.eb
	deleted:    s/Singularity/Singularity-2.4.eb
	deleted:    s/Singularity/Singularity-2.5.1.eb
	deleted:    s/Singularity/Singularity-2.6.0.eb
	deleted:    s/Singularity/Singularity-3.1.0.eb
	deleted:    s/Singularity/Singularity-3.2.1.eb
	deleted:    s/Singularity/Singularity-3.3.0.eb
	deleted:    s/Singularity/Singularity-3.4.1.eb
	deleted:    s/Singularity/Singularity-3.5.1.eb
	deleted:    s/Singularity/Singularity-3.5.2.eb
	deleted:    s/Singularity/Singularity-3.6.0.eb
 2020-09-15 10:21:34 +02:00
Lukáš Krupčík
5aa6d1e41b new file: l/libxc/libxc-4.3.4-intel-2019a-rt21497.eb 
new file:   s/Singularity/Singularity-3.6.2.eb
	new file:   v/VASP/VASP-6.1.1-intel-2020a-mkl=sequential.eb
	deleted:    l/libxc/libxc-4.3.4-intel-2019a.eb
 2020-09-10 08:02:17 +02:00
Lukáš Krupčík
fcc2abba71 modified: h/HTSlib/HTSlib-1.9-intel-2020a.eb 
deleted:    s/SciPy-bundle/SciPy-bundle-2020.03-intel-2020a-Python-3.8.2-LK.eb
	deleted:    s/SciPy-bundle/SciPy-bundle-2020.03-intel-2020a-Python-3.8.2.eb
 2020-08-27 13:23:14 +02:00
Josef Hrabal
5252308f85 modified: n/numpy/numpy-1.18.1-Py-3.6.eb 
modified:   n/numpy/numpy-1.18.1-Py-3.7.eb
	new file:   n/numpy/numpy-1.18.2-mkl.patch
	new file:   n/numpy/numpy-1.18.3-intel-2020a-Python-3.8.2.eb
	new file:   s/SciPy-bundle/SciPy-bundle-2020.03-intel-2020a-Python-3.8.2-LK.eb
	new file:   s/SciPy-bundle/SciPy-bundle-2020.03-intel-2020a-Python-3.8.2.eb
 2020-08-27 10:31:56 +02:00
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
39e4ef3cf2 new file: p/ParaView/ParaView-5.6.2-foss-2020a-Python-3.7.8-mpi.eb 
new file:   p/Python/Python-3.7.8-GCCcore-9.3.0.eb
	new file:   p/pybind11/pybind11-2.4.3-GCCcore-9.3.0-Python-3.7.8.eb
	new file:   s/SciPy-bundle/SciPy-bundle-2020.03-foss-2020a-Python-3.7.8.eb
	deleted:    p/ParaView/ParaView-5.6.2-foss-2020a-Python-3.7.4-mpi.eb
 2020-07-28 09:29:25 +02:00
Lukáš Krupčík
d3593bd9a7 new file: b/Boost/Boost-1.72.0-intel-2020a-Py-3.7.eb 
new file:   c/CGAL/CGAL-4.11.1-intel-2020a.eb
	new file:   c/CGAL/CGAL-5.0.2-intel-2020a.eb
	new file:   d/DOLFIN/DOLFIN-2019.1.0-intel-2020a-Py-3.7.eb
	new file:   f/FFC/FFC-2019.1.0-conda.eb
	new file:   m/MATIO/MATIO-1.5.12-intel-2020a.eb
	new file:   m/mshr/mshr-2019.1.0-conda.eb
	modified:   o/OpenMPI/OpenMPI-1.10.7-GCC-6.3.0-2.27-noPBS.eb
	new file:   o/OpenMPI/OpenMPI-3.1.6-GCCcore-8.3.0-noPBS.eb
	new file:   s/SLEPc/SLEPc-3.13.3-intel-2020a.eb
	new file:   s/SLEPc/SLEPc-3.9.2-intel-2020a.eb
	new file:   t/Trilinos/Trilinos-12.12.1-intel-2020a-Py-3.7.eb
 2020-07-21 12:50:01 +02:00
Lukáš Krupčík
aead00548f modified: o/OpenFOAM/OpenFOAM-7-foss-2020a.eb 
new file:   s/Singularity/Singularity-3.6.0.eb
 2020-07-20 09:57:44 +02:00
Lukáš Krupčík
7be072dda3 new file: m/METIS/METIS-5.1.0-foss-2020a.eb 
new file:   o/OpenFOAM/OpenFOAM-7-foss-2020a.eb
	new file:   p/Pango/Pango-1.45.3.eb
	new file:   s/SCOTCH/SCOTCH-6.0.9-foss-2020a.eb
	modified:   v/VTune/VTune-2018_update4.eb
	modified:   v/VTune/VTune-2019_update8.eb
 2020-07-16 14:05:40 +02:00
Lukáš Krupčík
e91765c8cb new file: f/foss/foss-2019a.eb 
new file:   g/gompi/gompi-2019a.eb
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	new file:   m/magma/magma-2.5.3-foss-2018a-CUDA.eb
	new file:   m/magma/magma-2.5.3_Fix_makefile_for_intel.patch
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 2020-06-29 08:33:40 +02:00
Lukáš Krupčík
44b3b0b96d new file: o/OpenBLAS/OpenBLAS-0.3.5-GCC-8.3.0-2.32.eb 
new file:   s/ScaLAPACK/ScaLAPACK-2.0.2-gompi-2019b-OpenBLAS-0.3.5.eb
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 2020-05-26 11:22:26 +02:00
Lukáš Krupčík
e8edf1a12c modified: archive/g/GROMACS/GROMACS-5.1.2-foss-2015g-hybrid-single-CUDA-7.5-PLUMED.eb 
modified:   archive/g/GROMACS/GROMACS-5.1.2-foss-2016a-hybrid-single-CUDA-7.5-PLUMED-2.3b.eb
	modified:   archive/g/GROMACS/GROMACS-5.1.2-intel-2015b-hybrid-single-CUDA-7.5-PLUMED-2.2.1.eb
	modified:   archive/g/GROMACS/GROMACS-5.1.2-intel-2015b-hybrid-single-cuda.eb
	modified:   archive/g/GROMACS/GROMACS-5.1.2-intel-2016a-hybrid-single-cuda.eb
	modified:   archive/p/PLUMED/PLUMED-2.3.0-foss-2016a.eb
	modified:   e/EasyBuild/EasyBuild-4.1.0.eb
	modified:   g/GROMACS/GROMACS-5.1.4-foss-2017a-hybrid-single-PLUMED.eb
	modified:   l/libmatheval/libmatheval-1.1.8-foss-2017a.eb
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	modified:   o/OpenMPI/OpenMPI-2.0.1-iccifort-2017.1.132-GCC-5.4.0-2.26.eb
	modified:   o/OpenMPI/OpenMPI-2.0.1.eb
	modified:   p/PSBLAS/PSBLAS-ext-1.0-4.eb
	modified:   p/Py/Py-2.7.old.eb
	modified:   p/pscom/pscom-5.0.48-1.eb
	modified:   s/spGPU/spGPU-master.eb
	deleted:    o/OVITO/OVITO-3.0.0.eb
 2020-05-19 09:52:32 +02:00
Lukáš Krupčík
61102f5a70 new file: p/PyYAML/PyYAML-5.3.1-Py-3.7.eb 
new file:   p/phonopy/phonopy-2.6.1-intel-2020a-Py-3.7.eb
	modified:   s/Score-P/Score-P-6.0-intel-2020a.eb
	new file:   w/wheel/wheel-0.34.2-Py-3.7.eb
 2020-05-18 10:20:51 +02:00
Lukáš Krupčík
5afd39d628 modified: s/Score-P/Score-P-6.0-intel-2020a.eb 2020-05-15 13:12:16 +02:00
Lukáš Krupčík
387197e8d3 new file: m/MUMPS/MUMPS-5.3.1-intel-2018a-parmetis.eb 
new file:   m/MUMPS/MUMPS-5.3.1-intel-2020a-parmetis.eb
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 2020-05-15 12:41:22 +02:00
Lukáš Krupčík
cdb10c2980 new file: d/decorator/decorator-4.4.0-Py-3.7.eb 
new file:   d/deepdiff/deepdiff-4.0.6-Py-3.7.eb
	new file:   n/networkx/networkx-2.3-Py-3.7.eb
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	new file:   p/Pint/Pint-0.11-Py-3.7.eb
	new file:   p/pydantic/pydantic-1.4-Py-3.7.eb
	modified:   s/ShiftX2/ShiftX2-1.13.eb
	deleted:    n/networkx/networkx-2.3-Py-2.7.eb
 2020-04-03 08:02:22 +02:00
Lukáš Krupčík
c9acbe8a17 new file: b/BLAST/BLAST-2.10.0-Linux_x86_64.eb 
modified:   o/OpenCV/OpenCV-4.2.0-intel-2020a-Py-3.7.eb
	new file:   s/ShiftX2/ShiftX2-1.13.eb
 2020-04-02 09:55:08 +02:00
Josef
7b3449095d new file: a/ATK/ATK-2.34.1-GCCcore-8.3.0.eb 
new file:   a/at-spi2-atk/at-spi2-atk-2.34.1-GCCcore-8.3.0.eb
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	modified:   b/Boost/Boost-1.72.0-intel-2020a.eb
	modified:   b/binutils/binutils-2.32-GCCcore-8.3.0.eb
	new file:   b/bzip2/bzip2-1.0.8-GCCcore-8.3.0.eb
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	new file:   d/DBus/DBus-1.13.8-GCCcore-8.3.0.eb
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	new file:   f/FriBidi/FriBidi-1.0.9-GCCcore-8.3.0.eb
	new file:   f/fontconfig/fontconfig-2.12.6-GCCcore-8.3.0.eb
	new file:   g/GLib/GLib-2.64.0-GCCcore-8.3.0.eb
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	modified:   g/GTK+/GTK+-3.24.13-GCCcore-8.3.0.eb
	new file:   g/Gdk-Pixbuf/Gdk-Pixbuf-2.38.2-GCCcore-8.3.0.eb
	new file:   g/gettext/gettext-0.19.8.1-GCCcore-8.3.0.eb
	modified:   h/HDF5/HDF5-1.10.6-intel-2020a.eb
	new file:   h/HarfBuzz/HarfBuzz-2.6.4-GCCcore-8.3.0.eb
	new file:   i/ICU/ICU-64.2-GCCcore-8.3.0.eb
	new file:   j/JasPer/JasPer-2.0.14-GCCcore-8.3.0.eb
	new file:   l/LibTIFF/LibTIFF-4.1.0-GCCcore-8.3.0.eb
	new file:   l/libffi/libffi-3.3-GCCcore-8.3.0.eb
	new file:   l/libjpeg-turbo/libjpeg-turbo-2.0.4-GCCcore-8.3.0.eb
	modified:   m/Mesa/Mesa-19.2.1-GCCcore-8.3.0.eb
	new file:   n/ncurses/ncurses-6.1-GCCcore-8.3.0.eb
	modified:   n/netCDF/netCDF-4.7.3-intel-2020a.eb
	modified:   n/numpy/numpy-1.18.1-Py-3.7.eb
	modified:   o/OpenCV/OpenCV-3.4.7-intel-2020a-Py-3.7.eb
	new file:   o/OpenCV/OpenCV-4.2.0-intel-2020a-Py-3.7.eb
	new file:   o/OpenCV/OpenCV-4.2.0_disable-AVX512-CascadeLake.patch
	new file:   p/Pango/Pango-1.44.7-GCCcore-8.3.0.eb
	modified:   p/Py/Py-3.6.eb
	modified:   p/Py/Py-3.7.eb
	modified:   p/Py/Py-3.8.eb
	new file:   p/Python/Python-3.6.10-GCCcore-8.3.0-base.eb
	new file:   p/Python/Python-3.7.7-GCCcore-8.3.0-base.eb
	modified:   p/Python/Python-3.8.2-GCC-8.3.0-2.32-base.eb
	new file:   p/Python/Python-3.8.2-GCCcore-8.3.0-base.eb
	new file:   s/SQLite/SQLite-3.30.1-GCCcore-8.3.0.eb
	new file:   t/Tcl/Tcl-8.6.10-GCCcore-8.3.0.eb
	modified:   v/VTK/VTK-8.2.0-foss-2019b-Python-3.7.4.eb
	modified:   v/VTK/VTK-8.2.0-intel-2020a-Py-3.7.eb
	modified:   x/X11/X11-20190717-GCCcore-8.3.0.eb
	modified:   x/XZ/XZ-5.2.4-GCCcore-8.3.0.eb
	new file:   x/x264/x264-20190925-GCCcore-8.3.0.eb
	new file:   x/x265/x265-3.2-GCCcore-8.3.0.eb
	deleted:    o/OpenCV/OpenCV-4.2.0-Py-3.7.eb
 2020-03-31 13:10:58 +02:00
Lukáš Krupčík
af7c299c32 new file: m/mkl/mkl-2020.0.166.eb 
new file:   p/ParMETIS/ParMETIS-4.0.3-gompi-2019b.eb
	modified:   p/PyQt5/PyQt5-5.13.1-Py-3.7.eb
	modified:   q/Qt5/Qt5-5.13.1.eb
	new file:   s/SuperLU_DIST/SuperLU_DIST-6.3.0-gompi-2019b.eb
 2020-03-26 08:27:44 +01:00
Lukáš Krupčík
b89822ffa2 new file: a/ASE/ASE-3.18.1-Py-3.7.eb 
new file:   b/BoltzTraP2/BoltzTraP2-20.2.1-Py-3.7.eb
	new file:   c/click/click-7.0-Py-3.7.eb
	modified:   h/h5py/h5py-2.9.0-Py-3.7.eb
	new file:   l/LLVM/LLVM-8.0.1-GCCcore-8.3.0.eb
	modified:   m/matplotlib/matplotlib-3.1.0-Py-3.7.eb
	new file:   m/mpmath/mpmath-1.1.0-Py-3.7.eb
	modified:   n/numba/numba-0.48.0-Py-3.7.eb
	new file:   s/scipy/scipy-1.3.3-Py-3.7.eb
	new file:   s/spglib/spglib-1.14.1-Py-3.7.eb
	deleted:    s/scipy/scipy-1.4.1-Py-3.7.eb
 2020-03-23 07:39:21 +01:00
Lukáš Krupčík
09acf73cad new file: h/Hypre/Hypre-2.18.2-intel-2020a.eb 
new file:   n/numba/numba-0.48.0-Py-3.7.eb
	modified:   p/PETSc/PETSc-3.12.4-intel-2020a.eb
	new file:   p/petsc4py/petsc4py-3.12.0-Py-3.7.eb
	new file:   p/pybind11/pybind11-2.4.3-Py-3.7.eb
	new file:   s/SLEPc/SLEPc-3.12.2-intel-2020a.eb
	new file:   s/scipy/scipy-1.4.1-Py-3.7.eb
	modified:   s/slepc4py/slepc4py-3.12.0-Py-3.7.eb
 2020-03-20 07:49:20 +01:00
Lukáš Krupčík
039bd42f11 new file: m/METIS/METIS-5.1.0-intel-2020a.eb 
new file:   m/MUMPS/MUMPS-5.2.1-intel-2020a-metis.eb
	new file:   p/PETSc/PETSc-3.12.4-intel-2020a.eb
	new file:   p/Py/Py-3.8.eb
	new file:   p/Python/Python-3.8.2-GCC-8.3.0-2.32-base.eb
	new file:   s/SCOTCH/SCOTCH-6.0.9-intel-2020a.eb
	new file:   s/SuiteSparse/SuiteSparse-5.6.0-intel-2020a-METIS-5.1.0.eb
	new file:   s/slepc4py/slepc4py-3.12.0-Py-3.7.eb
 2020-03-18 11:56:37 +01:00
Lukáš Krupčík
e074658ae6 new file: c/Cube/Cube-4.4.4-GCCcore-8.3.0.eb 
new file:   c/CubeGUI/CubeGUI-4.4.4-GCCcore-8.3.0.eb
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	new file:   c/CubeWriter/CubeWriter-4.4.3-GCCcore-8.3.0.eb
	new file:   o/OPARI2/OPARI2-2.0.5-GCCcore-8.3.0.eb
	new file:   o/OTF2/OTF2-2.2-GCCcore-8.3.0.eb
	new file:   p/PAPI/PAPI-5.7.0-GCCcore-8.3.0.eb
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	new file:   p/PyQt5/PyQt5-5.13.1-Py-3.7.eb
	new file:   p/packaging/packaging-20.3-Py-3.7.eb
	new file:   q/Qt5/Qt5-5.13.1-GCCcore-8.3.0.eb
	new file:   s/SIONlib/SIONlib-1.7.4-GCCcore-8.3.0-tools.eb
	new file:   s/SIP/SIP-5.1.1-Py-3.7.eb
	modified:   s/Score-P/Score-P-6.0-intel-2020a.eb
	new file:   t/toml/toml-0.10.0-Py-3.6.eb
	new file:   t/toml/toml-0.10.0-Py-3.7.eb
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 2020-03-13 08:45:50 +01:00
Lukáš Krupčík
a16a0cd8c1 new file: c/Cube/Cube-4.4.4-intel-2020a.eb 
new file:   c/CubeGUI/CubeGUI-4.4.4-intel-2020a.eb
	new file:   c/CubeLib/CubeLib-4.4.4-intel-2020a.eb
	new file:   f/FFTW/FFTW-3.3.8-intel-2020a.eb
	modified:   l/libGLU/libGLU-9.0.0.eb
	new file:   o/OTF2/OTF2-2.2.eb
	new file:   q/Qt5/Qt5-5.14.1.eb
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 2020-03-09 10:57:26 +01:00
Josef Hrabal
9db224585c new file: b/BAGEL/BAGEL-1.2.2-intel-2017a.eb 
new file:   h/HDF5/HDF5-1.10.6-foss-2017b-parallel.eb
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 2020-02-06 12:51:09 +01:00
Lukáš Krupčík
c1fff69173 new file: a/attrs/attrs-19.3.0-Py-3.7.eb 
new file:   b/BAGEL/BAGEL-1.2.2-intel-2020a.eb
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	new file:   p/Py/Py-system.eb
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 2020-02-05 08:44:31 +01:00
Lukáš Krupčík
d3cb8adf17 new file: b/Biopython/Biopython-1.76-Py-3.7.eb 
new file:   b/bzip2/bzip2-1.0.8.eb
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	new file:   c/cairo/cairo-1.17.2.eb
	modified:   e/Eigen/Eigen-3.3.7.eb
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	new file:   "l/libpng/\\"
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	modified:   n/numpy/numpy-1.18.1-Py-3.6.eb
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	modified:   o/OpenBabel/OpenBabel-2.4.9-GCCcore-6.3.0-Python-3.7.3.eb
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	modified:   p/Py/Py-3.7.eb
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	new file:   p/phono3py/phono3py-1.18.2-conda.eb
	new file:   p/phonopy/phono3py-1.18.2-conda.eb
	new file:   p/phonopy/phonopy-2.4.2-conda.eb
	new file:   p/pixman/pixman-0.38.4.eb
	new file:   s/SQLite/SQLite-3.30.1.eb
	new file:   s/SWIG/SWIG-3.0.12-Py-3.7.eb
	new file:   s/SWIG/SWIG-4.0.1-Py-3.7.eb
	new file:   t/Tcl/Tcl-8.6.10.eb
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	deleted:    p/phono3py/phono3py-1.18.2-Py-3.6.eb
 2020-01-09 11:14:33 +01:00
Lukáš Krupčík
a6b9e23443 new file: o/OCaml/OCaml-4.09.0-GCC-6.3.0-2.27.eb 
new file:   o/OCaml/OCaml-4.09.0.eb
	modified:   s/Singularity/Singularity-3.5.2.eb
	new file:   u/Unison/Unison-2.51.2-GCC-6.3.0-2.27.eb
	new file:   v/VASP/VASP-5.4.4-intel-2017c-mkl=cluster-Wannier.eb
	new file:   w/Wannier90/Wannier90-3.0.0-intel-2017c.eb
 new files yourself (see 'git help status').
 2020-01-08 09:50:45 +01:00
Lukáš Krupčík
15391d84fe new file: g/Go/Go-1.13.5.eb 
modified:   p/PETSc/PETSc-3.12.2-intel-2018a-it4i.eb
	new file:   p/PETSc/PETSc-3.12.2-intel-2019a-it4i.eb
	modified:   s/Singularity/Singularity-3.5.2.eb
 2019-12-19 11:49:24 +01:00
Lukáš Krupčík
ed2a487c33 new file: s/Singularity/Singularity-3.5.2.eb 2019-12-19 09:58:45 +01:00
Lukáš Krupčík
d9707a13c2 new file: j/Java/JAVA-1.9.0+181-PGI-18.5-GCC-6.3.0-2.27.eb 
new file:   j/Java/Java-1.8.0_121.eb
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 2019-12-17 08:11:50 +01:00