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Daniel J. Cole, Katherine Fowler, Ian R. Hardcastle, Summer Paton, Rachael Pirie, Harriet A. Stanway-Gordon, Hannah L. Stewart, Jack Tyerman, Kirsty L. Wilson and Michael J. Waring

Code to accompany the above paper.
Code to accompany the above paper, which can be found [here](https://pubs.rsc.org/en/content/articlepdf/2024/md/d4md00160e).

Dependencies:
- RDKit - https://www.rdkit.org/docs/Install.html
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