gromacswrapper
A Python wrapper around the Gromacs tools.
A Python wrapper around the Gromacs tools.
To install this package, run one of the following:
GromacsWrapper is a Python package that wraps system calls to GROMACS tools into thin classes. This allows for fairly seamless integration of the GROMACS tools into Python scripts.
Summary
A Python wrapper around the Gromacs tools.
Last Updated
Jul 12, 2025 at 20:37
License
GPL-3.0-or-later
Total Downloads
15.7K
Supported Platforms
GitHub Repository
https://github.com/Becksteinlab/GromacsWrapperDocumentation
https://gromacswrapper.readthedocs.io/