Ambertools Python Packages

acpype

OFFICIAL: AnteChamber PYthon Parser interfacE

gmx-mmpbsa

gmx_MMPBSA is a new tool based on AMBER's MMPBSA.py aiming to perform end-state free energy calculations with GROMACS files.

pytraj

Python interface of cpptraj

amber-mlips

MLIP wrapper for AMBER QM/MM (UMA, ORB, MACE, AIMNet2)