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Tools for studying long ranged —allosteric— effects in elastic networks (e.g. of proteins) on a mechanical basis.

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maxvossel/elastory

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elastory

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

Installation

Will be available as package on PyPI soon.

pip install elastory

Usage

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

Publication

Please have a look at our paper 📜 and cite us orcid 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}
}

Contributing

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

Project status

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. :)

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Tools for studying long ranged —allosteric— effects in elastic networks (e.g. of proteins) on a mechanical basis.

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