The bwHPC team provides and maintains software ranging from scientific (commercial) applications over math and communication libraries to performance tools.
To search for available software on the bwForClusters MLS&WISO, Nemo and BinAC go to the cluster information system (CIS), currently only in German:
Search available software on bwUniCluster 2.0 and bwForCluster JUSTUS 2
(last extracted @ 2021-01-26 23:00)
Software | Version | Category | Eligible | Cluster | Description | Variants |
---|---|---|---|---|---|---|
abaqus | 2019 | cae | KIT | bwUniCluster 2.0 | ABAQUS version 2019, simulation software | - |
abaqus | 2020 | cae | KIT | bwUniCluster 2.0 | ABAQUS version 2020, simulation software | - |
adf | 2019.304 | chem | all | bwForCluster JUSTUS 2 | Quantum chemistry package ADF (Amsterdam Density Functional Code) version 2019.304 (including AMS, ADF, Band, DFTB, ReaxFF, COSMO-RS) | - |
advisor | 2020.2 | devel | all | bwForCluster JUSTUS 2 | Intel(R) Advisor (advixe-gui, advixe-cl, ...) version 2020.2.0.606470 | - |
ams | 2020.101 | chem | all | bwForCluster JUSTUS 2 | - | - |
ansys | 19.1 | cae | HS_Esslingen | bwUniCluster 2.0 | ANSYS version 19.1, simulation software BW license manager | - |
ansys | 19.1 | cae | HS_Heilbronn | bwUniCluster 2.0 | ANSYS version 19.1, simulation software BW license manager | - |
ansys | 19.2 | cae | HS_Esslingen | bwUniCluster 2.0 | ANSYS version 19.2, simulation software BW license manager | - |
ansys | 19.2 | cae | HS_Heilbronn | bwUniCluster 2.0 | ANSYS version 19.2, simulation software BW license manager | - |
ansys | 19.2 | cae | KIT | bwUniCluster 2.0 | ANSYS version 19.2 CAE simulation software | - |
ansys | 19.5 | cae | HFT_Stuttgart | bwUniCluster 2.0 | ANSYS version 2019R3, simulation software BW license manager | - |
ansys | 2019R3 | cae | U_Hohenheim | bwUniCluster 2.0 | ANSYS version 19.5, simulation software | - |
ansys | 2020R2 | cae | HS_Esslingen | bwUniCluster 2.0 | ANSYS version 2020R2, simulation software BW license manager | - |
ansys | 2020R2 | cae | HS_Heilbronn | bwUniCluster 2.0 | ANSYS version 2020R2, simulation software BW license manager | - |
ansys | 2020R2 | cae | KIT | bwUniCluster 2.0 | ANSYS version 2020R2 CAE simulation software | - |
base | 3.8.6_gnu_10.2_jupyter_base | jupyter | all | bwUniCluster 2.0 | - | - |
base | 3.8.6_gnu_10.2 | jupyter | all | bwUniCluster 2.0 | - | - |
base | test | jupyter | all | bwUniCluster 2.0 | - | - |
blender | 2.82a | vis | all | bwUniCluster 2.0 | Blender 2.82a 3D modelling, animation and rendering tool | - |
blender | 2.90.1 | vis | all | bwUniCluster 2.0 | Blender 2.90.1 3D modelling, animation and rendering tool | - |
blender | 2.90 | vis | all | bwUniCluster 2.0 | Blender 2.90 3D modelling, animation and rendering tool | - |
cae | comsol | Core | U_Ulm | bwForCluster JUSTUS 2 | Multiphysics simulation package COMSOL version 5.6 | - |
cfour | 2.1_openmpi | chem | all | bwForCluster JUSTUS 2 | - | - |
cgal | 4.14.3 | lib | all | bwUniCluster 2.0 | CGAL library and tools version 4.14.3 | compiler/gnu/10.2 |
cgal | 5.1 | lib | all | bwUniCluster 2.0 | CGAL library and tools version 5.1 | compiler/gnu/10.2 |
cgns | 3.4.1-intel-19.1 | cae | all | bwUniCluster 2.0 | CGNS library and tools version 3.4.1 for Intel Compiler 19.1 | - |
chem | crystal17 | Core | U_Heidelberg | bwForCluster JUSTUS 2 | CRYSTAL package version 1.0.2 with compiler dependency on version compiler/intel/19.1.2 and MPI dependency on version mpi/openmpi/4.0 | - |
clang | 9.0 | compiler | all | bwUniCluster 2.0 | Sets up C language family frontend for LLVM version 9.0 in your environment | - |
cmake | 3.17.1 | devel | all | bwForCluster JUSTUS 2 | CMake 3.17.1 a cross-platform open-source build system | - |
cmake | 3.18 | devel | all | bwUniCluster 2.0 | CMake, a cross-platform open-source build system (version3.18.3) | - |
comsol | 5.5 | cae | KIT | bwUniCluster 2.0 | COMSOL version 5.5, simulation software | - |
comsol | 5.5 | cae | U_Hohenheim | bwUniCluster 2.0 | COMSOL version 5.5, simulation software | - |
comsol | 5.6 | cae | KIT | bwUniCluster 2.0 | COMSOL version 5.6, simulation software | - |
cp2k | 7.1 | chem | all | bwForCluster JUSTUS 2 | Quantum chemistry and solid state physics SW package. V. | - |
cp2k | 8.0_devel | chem | all | bwForCluster JUSTUS 2 | Quantum chemistry and solid state physics SW package. V. | - |
cst | 2020 | cae | KIT | bwUniCluster 2.0 | CST version 2020 | - |
cuda | 10.0 | devel | all | bwUniCluster 2.0 | Sets up cuda version 10.0 in your environment | - |
cuda | 10.1 | devel | all | bwUniCluster 2.0 | Sets up cuda version 10.1 in your environment | - |
cuda | 10.2 | devel | all | bwUniCluster 2.0 | Sets up cuda version 10.2 in your environment | - |
cuda | 11.0 | devel | all | bwUniCluster 2.0 | Sets up cuda version 11.0 in your environment | - |
cuda | 11.1 | devel | all | bwForCluster JUSTUS 2 | CUDA version 11.1.1 | - |
cuda | 9.2 | devel | all | bwUniCluster 2.0 | Sets up cuda version 9.2 in your environment | - |
cudnn | 10.0 | devel | all | bwUniCluster 2.0 | Sets up cudnn version 10.0 in your environment | - |
cudnn | 10.1 | devel | all | bwUniCluster 2.0 | Sets up cudnn version 10.1 in your environment | - |
cudnn | 10.2 | devel | all | bwUniCluster 2.0 | Sets up cudnn version 10.2 in your environment | - |
cudnn | 8.0.5 | lib | all | bwForCluster JUSTUS 2 | Sets up cudnn version 8.0.5.39 in your environment | - |
cudnn | 9.2 | devel | all | bwUniCluster 2.0 | Sets up cudnn version 9.2 in your environment | - |
forge | 20.1 | devel | all | bwUniCluster 2.0 | loads Debugging and Profiling Tool Forge in version 20.1 | - |
freesurfer | 6.0.0 | bio | all | bwUniCluster 2.0 | FreeSurfer version 6.0.0 | - |
fsl | 6.0.4 | bio | all | bwUniCluster 2.0 | FSL version 6.0.4 | - |
gamess | 2020.2 | chem | all | bwForCluster JUSTUS 2 | The General Atomic and Molecular Electronic Structure System (GAMESS) version 2020.2 is a general ab initio quantum chemistry package. | - |
gaussian | g16.C.01 | chem | all | bwForCluster JUSTUS 2 | Quantum chemistry package Gaussian (command g16) version g16.C.01 | - |
gaussview | 6.1.1 | chem | all | bwForCluster JUSTUS 2 | Graphical user interface (command gaussview) version 6.1.1 for Gaussian g16 (default) (restricted to members of Ulm University) | - |
gdb | 10.1 | devel | all | bwForCluster JUSTUS 2 | GDB 10.1 debugger | - |
gdb | 10.1 | devel | all | bwUniCluster 2.0 | GDB 10.1 debugger | - |
gdb | 9.2 | devel | all | bwForCluster JUSTUS 2 | GDB 9.2 debugger | - |
gdb | 9.2 | devel | all | bwUniCluster 2.0 | GDB 9.2 debugger | - |
gnuplot | 5.2 | vis | all | bwForCluster JUSTUS 2 | GNUplot 5.2.8 visualization and analysis tool | - |
gnuplot | 5.4.0 | vis | all | bwUniCluster 2.0 | GNUplot 5.4.0 visualization and analysis tool | - |
gnu | 10.1 | compiler | all | bwForCluster JUSTUS 2 | GNU compiler suite version 10.1.0 (gcc, g++, gfortran, gccgo) | - |
gnu | 10.2 | compiler | all | bwForCluster JUSTUS 2 | GNU compiler suite version %VERSION% (gcc, g++, gfortran, gccgo) including LTO and JIT | - |
gnu | 10.2 | compiler | all | bwUniCluster 2.0 | GNU compiler suite version 10.2.0 (gcc, g++, gfortran, gccgo) including LTO and JIT | - |
gnu | 8.3.1 | compiler | all | bwUniCluster 2.0 | Sets up GCC C/C++/Fortran compiler version 8.3.1 in your environment - SYSTEM COMPILER! | - |
gnu | 9.3 | compiler | all | bwForCluster JUSTUS 2 | GNU compiler suite version 9.3.0 (gcc, g++, gfortran, gccgo) including LTO and JIT | - |
gnu | 9.3 | compiler | all | bwUniCluster 2.0 | GNU compiler suite version 9.3.0 (gcc, g++, gfortran, gccgo) including LTO and JIT | - |
gnu | system | compiler | all | bwForCluster JUSTUS 2 | Dummy module for the system GNU compiler suite version 8.3.1 (gcc, g++, gfortran, gccgo) | - |
grace | 5.1.25 | vis | all | bwForCluster JUSTUS 2 | Grace is a WYSIWYG tool to make two-dimensional plots of numerical data, version 5.1.25 | - |
gromacs | 2020.2 | chem | all | bwForCluster JUSTUS 2 | GROMACS - GROningen MAchine for Chemical Simulations, version 2020.2_openmpi-4.0 with compiler dependency on version compiler/gnu/system and MPI dependency on version mpi/openmpi/4.0 | - |
gromacs | 2020.4 | chem | all | bwForCluster JUSTUS 2 | GROMACS - GROningen MAchine for Chemical Simulations, version 2020.4-openmpi-4.0 with compiler dependency on version compiler/gnu/system and MPI dependency on version mpi/openmpi/4.0 | - |
gromacs | 2020.4 | chem | all | bwUniCluster 2.0 | GROMACS - GROningen MAchine for Chemical Simulations, version 2020.4-gnu-8.3.1-openmpi-4.0-cuda-10.2 with dependency on compiler/gnu/8.3.1, mpi/openmpi/4.0 and devel/cuda/10.2 | - |
gsl | 2.6-gnu-9.2 | numlib | all | bwUniCluster 2.0 | GSL - GNU Scientific Library, version 2.6 with compiler dependency on version compiler/gnu/9.2 | - |
gsl | 2.6-intel-19.1 | numlib | all | bwForCluster JUSTUS 2 | GSL - GNU Scientific Library, version 2.6 with compiler dependency on version compiler/intel/19.1 | - |
gsl | 2.6-intel-19.1 | numlib | all | bwUniCluster 2.0 | GSL - GNU Scientific Library, version 2.6 with compiler dependency on version compiler/intel/19.1 | - |
gsl | 2.6 | numlib | all | bwForCluster JUSTUS 2 | GSL - GNU Scientific Library, version 2.6 with compiler dependency on version compiler/gnu/system | - |
hdf5 | 1.12.0-gnu-10.2-openmpi-4.0 | lib | all | bwUniCluster 2.0 | HDF5 library and tools version 1.12.0-openmpi-4.0-gnu-10.2 with mpi dependency on version openmpi/4.0 | - |
hdf5 | 1.12.0-gnu-8.3 | lib | all | bwUniCluster 2.0 | HDF5 library and tools version 1.12.0-gnu-8.3 with compiler dependency on version gnu/8.3 | - |
hdf5 | 1.12.0-intel-19.1-openmpi-4.0 | lib | all | bwUniCluster 2.0 | HDF5 library and tools version 1.12.0-openmpi-4.0-intel-19.1 with mpi dependency on version openmpi/4.0 | - |
hdf5 | 1.12.0-intel-19.1 | lib | all | bwUniCluster 2.0 | HDF5 library and tools version 1.12.0-intel-19.1 with compiler dependency on version intel/19.1 | - |
hdf5 | 1.12.0-pgi-2020-openmpi-4.0 | lib | all | bwUniCluster 2.0 | HDF5 library and tools version 1.12.0-openmpi-4.0-pgi-2020 with mpi dependency on version openmpi/4.0 | - |
hdf5 | 1.8.21-intel-19.1-impi-2019.7 | lib | all | bwForCluster JUSTUS 2 | HDF5 library and tools version 1.8.21_intel-19.1_impi-2019.7 | - |
hdf5 | 1.8.21-intel-19.1 | lib | all | bwForCluster JUSTUS 2 | HDF5 library and tools version 1.8.21_intel-19.1 | - |
hida | kruse | workshops | all | bwUniCluster 2.0 | python 3.6 | - |
hida | neutrons_maskrcnn | workshops | all | bwUniCluster 2.0 | python 3.6 | - |
impi | 2019.5 | mpi | all | bwForCluster JUSTUS 2 | Intel MPI bindings (mpicc mpicxx mpif77 mpif90) version 2019.5.281 for | compiler/gnu/.9.3.0 compiler/gnu/9.3 compiler/gnu/system compiler/intel/19.0 |
impi | 2019.7 | mpi | all | bwForCluster JUSTUS 2 | Intel MPI bindings (mpicc mpicxx mpif77 mpif90) version 2019.7.217 for | compiler/gnu/.9.3.0 compiler/gnu/9.3 compiler/gnu/system compiler/intel/19.1 |
impi | 2019.8 | mpi | all | bwForCluster JUSTUS 2 | Intel MPI bindings (mpicc mpicxx mpif77 mpif90) version 2019.8.254 for | compiler/gnu/.9.3.0 compiler/gnu/9.3 compiler/gnu/system compiler/intel/19.1.2 |
impi | 2019 | mpi | all | bwUniCluster 2.0 | Sets up Intel MPI version 2019 in your environment | compiler/clang/9.0 compiler/intel/18.0 compiler/intel/19.0 compiler/intel/19.1 compiler/llvm/10.0 |
impi | 2020 | mpi | all | bwUniCluster 2.0 | Sets up Intel MPI version 2020 in your environment | compiler/clang/9.0 compiler/intel/18.0 compiler/intel/19.0 compiler/intel/19.1 compiler/llvm/10.0 |
inspector | 2020.2 | devel | all | bwForCluster JUSTUS 2 | Intel(R) Inspector (inspxe-gui, inspxe-cl, ...) version 2020.2.0.604588 | - |
intel | 18.0 | compiler | all | bwUniCluster 2.0 | Sets up Intel C/C++ and Fortran compiler version 18.0 (Intel(R) Compilers 18.0 for Linux*) - supported by SCC till 2020-12-31! | - |
intel | 19.0 | compiler | all | bwForCluster JUSTUS 2 | Intel(R) compiler suite (icc, icpc, ifort), debugger (gdb-ia), IPP and TBB ver 19.0.5.281 | - |
intel | 19.0 | compiler | all | bwUniCluster 2.0 | Sets up Intel C/C++ and Fortran compiler version 19.0 (Intel(R) Compilers 19.0 for Linux*) - supported by SCC till 2021-12-31! | - |
intel | 19.1.2 | compiler | all | bwForCluster JUSTUS 2 | Intel(R) compiler suite (icc, icpc, ifort), debugger (gdb-ia), IPP and TBB ver 19.1.2.254 | - |
intel | 19.1 | compiler | all | bwForCluster JUSTUS 2 | Intel(R) compiler suite (icc, icpc, ifort), debugger (gdb-ia), IPP and TBB ver 19.1.1.217 | - |
intel | 19.1 | compiler | all | bwUniCluster 2.0 | Sets up Intel C/C++ and Fortran compiler version 19.1 (Intel(R) Compilers 19.1 for Linux*) - supported by SCC till 2022-12-31! | - |
itac | 2020.2 | devel | all | bwForCluster JUSTUS 2 | Intel(R) Trace Analyser and Collector (traceanalyzer, xstftool, stftool, ...) version 2020.2.031 | - |
jmol | 14.31.3 | chem | all | bwForCluster JUSTUS 2 | - | - |
julia | 1.3.1 | math | all | bwUniCluster 2.0 | The Julia programming language for numerical computing | - |
julia | 1.4.2 | math | all | bwForCluster JUSTUS 2 | The Julia programming language for numerical computing, version 1.4.2 | - |
jupyter_base | 2020-09-30 | devel | all | bwUniCluster 2.0 | python 3.6 | - |
jupyter_ml | 2020-09-01 | devel | all | bwUniCluster 2.0 | python 3.6 | - |
lammps | stable_3Mar2020 | chem | all | bwForCluster JUSTUS 2 | - | - |
llvm | 10.0 | compiler | all | bwUniCluster 2.0 | Sets up C language family frontend for LLVM version 10.0 in your environment | - |
lsdyna | 12.0.0 | cae | KIT | bwUniCluster 2.0 | LSDYNA version 12.0.0, simulation software | - |
lsdyna | 9.3.1 | cae | KIT | bwUniCluster 2.0 | LSDYNA version 931, simulation software | - |
mathematica | 12.1.1 | math | U_Mannheim | bwUniCluster 2.0 | Mathematica version | - |
mathematica | 12.1 | math | KIT | bwUniCluster 2.0 | MATHEMATICA version 12.1, Numerical Math package. | - |
mathematica | 12.2 | math | KIT | bwUniCluster 2.0 | MATHEMATICA version 12.2, Numerical Math package. | - |
matlab | R2019b | math | all | bwUniCluster 2.0 | MATLAB version R2019b, Numerical Math package. | - |
matlab | R2020a | math | all | bwForCluster JUSTUS 2 | MATLAB version R2020a, Numerical Math package | - |
matlab | R2020a | math | all | bwUniCluster 2.0 | MATLAB version R2020a, Numerical Math package. | - |
matlab | R2020b | math | all | bwUniCluster 2.0 | MATLAB version R2020b, Numerical Math package. | - |
miniconda | 4.8.2 | devel | all | bwUniCluster 2.0 | - | - |
mkl | 2018 | numlib | all | bwUniCluster 2.0 | Sets up Intel Mathematical Kernel Library (MKL) 2018 (Intel(R) Math Kernel Library 2018 for Linux) | - |
mkl | 2019 | numlib | all | bwForCluster JUSTUS 2 | Intel(R) Math Kernel Library MKL (BLAS, LAPACK, FFTW, ...) version 2019.5.281 | - |
mkl | 2019 | numlib | all | bwUniCluster 2.0 | Sets up Intel Mathematical Kernel Library (MKL) 2019 (Intel(R) Math Kernel Library 2019 for Linux) | - |
mkl | 2020.2 | numlib | all | bwForCluster JUSTUS 2 | Intel(R) Math Kernel Library MKL (BLAS, LAPACK, FFTW, ...) version 2020.2.254 | - |
mkl | 2020 | numlib | all | bwForCluster JUSTUS 2 | Intel(R) Math Kernel Library MKL (BLAS, LAPACK, FFTW, ...) version 2020.1.217 | - |
mkl | 2020 | numlib | all | bwUniCluster 2.0 | Sets up Intel Mathematical Kernel Library (MKL) 2020 (Intel(R) Math Kernel Library 2020 for Linux) | - |
molcas | 8.4 | chem | all | bwForCluster JUSTUS 2 | - | - |
molden | 5.9 | chem | all | bwForCluster JUSTUS 2 | - | - |
molden | 6.5 | chem | all | bwUniCluster 2.0 | MOLDEN (Version 6.5) is a package for displaying Molecular Densities and Molecular Coordinates | - |
molpro | 2019.2.3 | chem | all | bwForCluster JUSTUS 2 | - | - |
molpro | 2020.1 | chem | all | bwForCluster JUSTUS 2 | - | - |
namd | 2.14 | chem | all | bwForCluster JUSTUS 2 | The molecular dynamics code NAMD 2.14_intel-19.1_impi-2019.7 with compiler dependency on version intel/19.1 and MPI dependency on version impi/2019.7 | - |
nbo | 6.0.18_i4 | chem | all | bwForCluster JUSTUS 2 | Natural Band Orbitals (NBO) analysis package (commands gennbo, gaunbo6 and application interfaces) version 6.0.18_i4 | - |
nbo | 6.0.18_i8 | chem | all | bwForCluster JUSTUS 2 | Natural Band Orbitals (NBO) analysis package (commands gennbo, gaunbo6 and application interfaces) version 6.0.18_i8 | - |
nest | 2.18.0 | bio | all | bwUniCluster 2.0 | - | - |
nest | 2.20.1 | bio | all | bwUniCluster 2.0 | - | - |
netcdf | 4.7.3-intel-19.1 | lib | all | bwUniCluster 2.0 | NETCDF library and tools version 4.7.3-intel-19.1 | - |
openbabel | 3.1.1 | chem | all | bwForCluster JUSTUS 2 | A converter between different file formats for 3D molecular structures (version 3.1.1) | - |
openfoam | 5.x | cae | all | bwUniCluster 2.0 | Open Source CFD Toolbox OpenFOAM version 5.x | - |
openfoam | 6 | cae | all | bwUniCluster 2.0 | Open Source CFD Toolbox OpenFOAM version 6 | - |
openfoam | 7 | cae | all | bwUniCluster 2.0 | Open Source CFD Toolbox OpenFOAM version 7 | - |
openfoam | 8 | cae | all | bwForCluster JUSTUS 2 | Open Source CFD Toolbox OpenFOAM version 8 | - |
openfoam | 8 | cae | all | bwUniCluster 2.0 | Open Source CFD Toolbox OpenFOAM version 8 | - |
openfoam | v2006 | cae | all | bwForCluster JUSTUS 2 | Open Source CFD Toolbox OpenFOAM version v2006 | - |
openfoam | v2006 | cae | all | bwUniCluster 2.0 | Open Source CFD Toolbox OpenFOAM version v2006 | - |
openfoam | v2012 | cae | all | bwForCluster JUSTUS 2 | Open Source CFD Toolbox OpenFOAM version v2012 | - |
openfoam | v2012 | cae | all | bwUniCluster 2.0 | Open Source CFD Toolbox OpenFOAM version v2012 | - |
openmolcas | 19.11 | chem | all | bwForCluster JUSTUS 2 | - | - |
openmpi | 2.1 | mpi | all | bwForCluster JUSTUS 2 | OpenMPI bindings (mpicc mpicxx mpifort) version 2.1.6-intel-19.1.2 for intel/19.1.2 | compiler/intel/19.1.2 |
openmpi | 4.0 | mpi | all | bwForCluster JUSTUS 2 | OpenMPI bindings (mpicc mpicxx mpifort) version 4.0. | compiler/gnu/.10.1.0 compiler/gnu/.10.2.0 compiler/gnu/.9.3.0 compiler/gnu/10.1 compiler/gnu/10.2 compiler/gnu/9.3 compiler/gnu/system compiler/intel/19.1 compiler/intel/19.1.2 compiler/pgi/18.10 compiler/pgi/18.10_static |
openmpi | 4.0 | mpi | all | bwUniCluster 2.0 | OpenMPI bindings (mpicc mpicxx mpifort) version 4.0.5- | compiler/clang/9.0 compiler/gnu/10.2 compiler/gnu/8.3.1 compiler/gnu/9.3 compiler/intel/18.0 compiler/intel/19.0 compiler/intel/19.1 compiler/llvm/10.0 compiler/pgi/2020 |
openmpi | default | mpi | all | bwUniCluster 2.0 | OpenMPI bindings (mpicc mpicxx mpifort) version 4.0.5-gnu-8.3 for gnu/8.3 | compiler/gnu/8.3.1 |
orca | 4.2.1 | chem | all | bwForCluster JUSTUS 2 | Quantum chemistry package ORCA. Libfabric and Hwloc Version 4.2.1. Command | - |
orca | 4.2.1-xtb-6.3.3 | chem | all | bwForCluster JUSTUS 2 | Quantum chemistry package ORCA Version 4.2.1-xtb with the interface to XTB Version 6.3.3. Command | - |
pahole | 1.18 | devel | all | bwUniCluster 2.0 | Dwarves 1.18 tools including pahole | - |
parallel | 20200522 | system | all | bwForCluster JUSTUS 2 | GNU parallel is a shell tool for executing jobs in parallel, version 20200522 | - |
paraview | 5.8.1 | vis | all | bwForCluster JUSTUS 2 | Open Source Software ParaView version5.8.1 | - |
paraview | 5.8 | cae | all | bwUniCluster 2.0 | Open Source Software ParaView version5.8.1 | - |
parbatch | 1.0 | system | all | bwUniCluster 2.0 | parbatch (Version 1.0) is mpirun based wrapper to work off parallel many small sequential jobs in one master job | - |
petsc | 3.12.4-gnu-9.2-openmpi-4.0 | numlib | all | bwUniCluster 2.0 | PETSc - Portable, Extensible Toolkit for Scientific Computation, version 3.12.4 with compiler dependency on version compiler/gnu/9.2 and mpi dependency on version openmpi/4.0 | - |
petsc | 3.13.4-gnu-10.2-openmpi-4.0 | numlib | all | bwUniCluster 2.0 | PETSc - Portable, Extensible Toolkit for Scientific Computation, version 3.13.4 with compiler dependency on version compiler/gnu/10.2 and mpi dependency on version openmpi/4.0 | - |
pgi | 18.10_static | compiler | all | bwForCluster JUSTUS 2 | PGI compiler (pgcc, pgc++, pgf90 - only static libs), debugger (pgdbg) ver 18.10 | - |
pgi | 18.10 | compiler | all | bwForCluster JUSTUS 2 | PGI compiler (pgcc, pgc++, pgf90 - with shared libs), debugger (pgdbg) ver 18.10 | - |
pgi | 2020 | compiler | all | bwUniCluster 2.0 | Changes the PGI home directory to Linux_x86_64 2020 | - |
povray | 3.7 | vis | all | bwUniCluster 2.0 | POVray 3.7.0.8 visualization and analysis tool | - |
python_matplotlib | 3.2.2_numpy-1.19.0_python-3.8.3 | lib | all | bwForCluster JUSTUS 2 | Matplotlib (version 3.2.2) is a Python 2D plotting library which produces publication quality figures. | - |
python_numpy | 1.19.0_python-3.8.3 | numlib | all | bwForCluster JUSTUS 2 | NumPy is the fundamental package for scientific computing in Python, (version 1.19.0_python-3.8.3) | - |
python_numpy | 1.19.1_python_3.8.6_gnu_10.2 | numlib | all | bwUniCluster 2.0 | - | - |
python_numpy | 1.19.1_python_3.8.6_intel_19.1 | numlib | all | bwUniCluster 2.0 | - | - |
python_scipy | 1.5.0_numpy-1.19.0_python-3.8.3 | numlib | all | bwForCluster JUSTUS 2 | SciPy provides many user-friendly and efficient numerical routines for numerical integration and optimization, (version 1.5.0_numpy-1.19.0_python-3.8.3) | - |
python_scipy | 1.5.2_numpy_1.19.1_python_3.8.6_gnu_10.2 | numlib | all | bwUniCluster 2.0 | - | - |
python_scipy | 1.5.2_numpy_1.19.1_python_3.8.6_intel_19.1 | numlib | all | bwUniCluster 2.0 | - | - |
python | 3.8.3 | devel | all | bwForCluster JUSTUS 2 | python 3.8.3 | - |
python | 3.8.6_gnu_10.2 | devel | all | bwUniCluster 2.0 | - | - |
python | 3.8.6_intel_19.1 | devel | all | bwUniCluster 2.0 | - | - |
qt | 5.12.4 | devel | all | bwForCluster JUSTUS 2 | Qt5 cross-platform application development framework version 5.12.4 | - |
qt | 5.14.2 | devel | all | bwForCluster JUSTUS 2 | Qt5 cross-platform application development framework version 5.14.2 | - |
quantum_espresso | 6.5 | chem | all | bwForCluster JUSTUS 2 | Integrated suite of computer codes for electronic-structure calculations and materials modeling at the nanoscale. Including EPW & GIPAW. | - |
qutip | 4.6.0-dev | phys | all | bwForCluster JUSTUS 2 | QuTiP (version 4.6.0-dev) | - |
reports | 20.0 | devel | all | bwUniCluster 2.0 | loads Performance-report Tool in version 20.0 | - |
R_gnu | 3.6.3-gnu-10.2 | math | U_Mannheim | bwUniCluster 2.0 | The R environment for statistical computing and graphics, version 3.6.3, built with GNU-compiler 10.2. If you do not depend on a GNU-compiled R, we recommend to continue using the math/R-module. | - |
R | 3.6.3 | math | all | bwUniCluster 2.0 | The R environment for statistical computing and graphics, version 3.6.3 | - |
schrodinger | 2020-2 | chem | all | bwForCluster JUSTUS 2 | Sets up the environment for Schrodinger Suite_2017u3 | - |
scorep | 6.0-gnu-10.2-openmpi-4.0 | devel | all | bwUniCluster 2.0 | ScoreP 6.0-gnu-10.2-openmpi-4.0 tracing and performance analysis tool | compiler/gnu/10.2 |
scotch | 6.1 | lib | all | bwUniCluster 2.0 | SCOTCH library and tools version 6.1 | compiler/gnu/10.2 |
siesta | 4.1-b4 | chem | all | bwForCluster JUSTUS 2 | SIESTA (version 4.1-b4_distributed-memory) | - |
ssh_wrapper | 0.1 | system | all | bwUniCluster 2.0 | SSH wrapper (Version 0.1) emulates SSH to allow passwordless remote shell access to different hosts within the given job resources. | - |
starccm+ | 2019.2.1 | cae | KIT | bwUniCluster 2.0 | StarCCM+ version 2019.2.1, simulation software | - |
starccm+ | 2019.2 | cae | HS_Esslingen | bwUniCluster 2.0 | STAR-CCM+ 14.04.013 | - |
starccm+ | 2019.2 | cae | HS_Heilbronn | bwUniCluster 2.0 | STAR-CCM+ 14.04.013 | - |
starccm+ | 2019.2 | cae | HS_Karlsruhe | bwUniCluster 2.0 | STAR-CCM+ 14.04.013 | - |
starccm+ | 2020.1-r8 | cae | HS_Heilbronn | bwUniCluster 2.0 | STAR-CCM+ 15.02.009-R8 | - |
starccm+ | 2020.1 | cae | HS_Esslingen | bwUniCluster 2.0 | STAR-CCM+ 15.02.009 | - |
starccm+ | 2020.1 | cae | KIT | bwUniCluster 2.0 | StarCCM+ version 2020.1, simulation software | - |
starccm+ | 2020.2 | cae | HS_Esslingen | bwUniCluster 2.0 | STAR-CCM+ 15.04.010 | - |
starccm+ | 2020.2 | cae | HS_Heilbronn | bwUniCluster 2.0 | STAR-CCM+ 15.04.010 | - |
starccm+ | 2020.2 | cae | KIT | bwUniCluster 2.0 | StarCCM+ version 2020.2, simulation software | - |
starcd | 2019.1.2 | cae | KIT | bwUniCluster 2.0 | StarCD version 2019.1.2, simulation software | - |
stata | 14 | math | U_Tuebingen | bwUniCluster 2.0 | - | - |
stata | 16 | math | U_Tuebingen | bwUniCluster 2.0 | - | - |
tecplot | 19.1 | vis | all | bwUniCluster 2.0 | The Tecplot visualization system, version 19.1 | - |
texinfo | 6.7 | system | all | bwForCluster JUSTUS 2 | Texinfo package (commands info, makeinfo, texi2dvi, ...) version 6.7 | - |
tigervnc | 1.9.0 | vis | all | bwForCluster JUSTUS 2 | TigerVNC, a high-performance, platform-neutral VNC implementation version 1.9.0 | - |
tmolex | 4.5.2 | chem | all | bwForCluster JUSTUS 2 | Quantum chemistry package TmoleX version 4.5.2 (the graphical user interface of TURBOMOLE 7.4.1) | - |
tmolex | 4.5.2 | chem | all | bwUniCluster 2.0 | Quantum chemistry package TmoleX version 4.5.2 (the graphical user interface of TURBOMOLE 7.4.1) | - |
tmolex | 4.6 | chem | all | bwForCluster JUSTUS 2 | Quantum chemistry package TmoleX version 4.6 (the graphical user interface of TURBOMOLE 7.4.1) | - |
turbomole | 7.4.1 | chem | all | bwForCluster JUSTUS 2 | Quantum chemistry package Turbomole version 7.4.1 | - |
turbomole | 7.4.1 | chem | all | bwUniCluster 2.0 | Quantum chemistry package Turbomole version 7.4.1 | - |
turbomole | 7.5 | chem | all | bwForCluster JUSTUS 2 | Quantum chemistry package Turbomole version 7.5 | - |
turbovnc | 2.2.5 | vis | all | bwUniCluster 2.0 | A highly-optimized version of VNC that can be used with performance-critical applications | - |
valgrind | 3.16.1 | devel | all | bwForCluster JUSTUS 2 | Valgrind 3.16.1 is a framework for thread and memory debugging and performance analysis | - |
valgrind | 3.16.1 | devel | all | bwUniCluster 2.0 | Valgrind 3.16.1 is a framework for thread and memory debugging and performance analysis | - |
vampir | 9.9 | devel | all | bwForCluster JUSTUS 2 | Vampir and VampirServer 9.9.0 tracing and performance analysis tool | - |
vampir | 9.9 | devel | all | bwUniCluster 2.0 | Vampir and VampirServer 9.9.0 tracing and performance analysis tool | - |
vasp | 5.4.4.3.16052018 | chem | all | bwForCluster JUSTUS 2 | Quantum chemistry package VASP (Vienna Ab initio Simulation Package) version 5.4.4.3.16052018_i191_avx2 (restricted to groups with VASP license) | - |
vasp | 5.4.4.pl2 | chem | KIT | bwUniCluster 2.0 | Enable usage of vasp 5.4.4.pl2 | - |
vmd | 1.9.3 | chem | all | bwForCluster JUSTUS 2 | - | - |
vtune_profiler | 2020.2 | devel | all | bwForCluster JUSTUS 2 | Intel(R) VTune Amplifier (amplxe-gui, amplxe-cl, ...) version 2020.2.0.610396 | - |
ws_addon | 0.1 | system | all | bwUniCluster 2.0 | ws_addon (Version 0.1) adds features to share and unshare workspaces. | - |
xtb | 6.3.3 | chem | all | bwForCluster JUSTUS 2 | Semiempirical Extended Tight-Binding Program Package V. | - |