Software
The group is participating in the development of GROMACS molecular dynamics simulator.
There are occasional contributions to other free and open-source software based on the requirements of the research projects we work on and courses we teach.
Packaging
The group is actively co-maintaining several computational biochemisty packages in Arch User Repository (AUR), specifically:
- AmberTools -> ambertools
- GROMACS -> gromacs
- MDAnalysis -> python-mdanalysis
- RDKit -> rdkit
Author: Vedran Miletić