Tools for studying long ranged —allosteric— effects in elastic networks (e.g. of proteins) on a mechanical basis.
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Look at our Examples · Reproduce our results

Will be available as package on PyPI soon.

pip install elastory

You might wan't to have a look at the examples.

Please have a look at our paper 📜 and cite us when using my code.

@misc{vossel2023allosteric,
    title={The allosteric lever: towards a principle of specific allosteric response},
    author={Maximilian Vossel and Bert L. de Groot and Aljaž Godec},
    year={2023},
    eprint={2311.12025},
    archivePrefix={arXiv},
    primaryClass={physics.bio-ph}
}

Pull requests are more than welcome. For major changes, please open an issue first to discuss what you would like to change or add.

Work on this project has slowed down since I left academia for an AI startup. I still like this project however and would be happy to help anyone using the code. I can not promise anything but will do my best to provide support. :)