Updated 9 months ago
https://github.com/akohlmey/lammps-gui
LAMMPS-GUI - The graphical interface for learning and running LAMMPS
Updated 10 months ago
ai-in-data-science-data-challenge
Solution to the Data Challenge task. Authors are Izabell Járó, Kristóf Benedek, and Marcell Emmer.
Updated 9 months ago
https://github.com/akohlmey/topotools
VMD plugin for manipulating topology information
Updated 10 months ago
pypseudo-mutation-analysis-on-python-to-detect-pseudotestedness-danniyb
A Mutation Tool for Python
Updated 9 months ago
https://github.com/akohlmey/vmd-irspec-plugins
VMD plugins for computing spectral densities