Needs to be migrated
https://support.hlrn.de/home/view/System4/AtosSoftware
- BLAS
- Charm++
- GROMACS
- LAPACK
- MUMPS
- Numerics
- ParaView
- Python
- RELION
- STAR-CCM+
- Scotch
- Singularity
- VASP
- Valgrind
- libtiff
- pigz
Needs to be created
- ASE
- BandUP
- Boost
- CGAL
- CMake
- CPMD
- GCC → Quickstart Guide?
- LAMMPS
- MOLPRO
- NWChem
- OpenMPI → Quickstart Guide?
- PLUMED
- Quantum ESPRESSO
- TURBOMOLE
- texlive
Engineering
Chemistry
Numerics
| Seite einschließen |
|---|
| Devtools, compiler and debugging |
|---|
| Devtools, compiler and debugging |
|---|
|
| Seite einschließen |
|---|
| Visualisation tools |
|---|
| Visualisation tools |
|---|
|
| Seite einschließen |
|---|
| Data Manipulation |
|---|
| Data Manipulation |
|---|
|
Miscellaneous software packages
| Seite einschließen |
|---|
| Miscellaneous |
|---|
| Miscellaneous |
|---|
|