- Add docstrings for functions and classes. - Add tests using `pytest` for functions and classes. - Add a Jupyter notebook showing examples of how to use `MDPropTools`.
Fixed
- Fix bug in identifying unique configurations in the `cluster_analysis` module.
0.0.4
Changed
- Modify diffusion and conductivity codes to avoid reading dump files all at once, resulting in improved memory efficiency and faster processing.
Fixed
- Update setup.py to ensure accurate dependency requirements. - Perform minor cleanups and bug fixes.