rgora/MoBioTools
A simple yet versatile toolkit to setup quantum mechanical/molecular mechanical (QM/MM) calculations from molecular dynamics trajectories.
PythonGPL-3.0
No issues in this repository yet.
A simple yet versatile toolkit to setup quantum mechanical/molecular mechanical (QM/MM) calculations from molecular dynamics trajectories.
PythonGPL-3.0
No issues in this repository yet.