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