# StereoMolGraph #
[](https://stereomolgraph.readthedocs.io)
[](https://www.python.org/)
[](https://opensource.org/licenses/MIT)
[](https://stereomolgraph.readthedocs.io/en/latest/?badge=dev)
[](https://github.com/maxim-papusha/StereoMolGraph)
[](https://github.com/maxim-papusha/StereoMolGraph/actions/workflows/run_type_check.yaml)
[](https://github.com/maxim-papusha/StereoMolGraph/actions/workflows/run_example_test.yaml)
[](https://github.com/maxim-papusha/StereoMolGraph/actions/workflows/run_unit_test.yaml)
[](https://doi.org/10.5281/zenodo.16360310)
[](https://pepy.tech/projects/stereomolgraph)
Work in progress and a manuscript in preparation.
More documentation and tutorials coming end of summer 2025
A lightweitht Python library for **Molecules** and **Transition States** with **Stereochemistry**.
The object oriendet structure abstracts aways the mathematical complexety of the regirous grouptheorethical threatment of stereochemistry.
Provides algorithmically fast and robust implementations of **hashing** based on the Weisfeiler-Leman algorithm and **equality** based on the VF2++ isomorphism algorithm.
## Documentation ##
## Installation ##
## Citation ##
## Contact ##
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