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Atom Mapping Python Packages

Python packages with the GitHub topic atom-mapping. Sorted by monthly downloads, with stars and forks.
rxn4chemistry
rxnmapper

RXNMapper: Unsupervised attention-guided atom-mapping. Code complementing our Science Advances publication on "Extraction of organic chemistry grammar from unsupervised learning of chemical reactions" (https://advances.sciencemag.org/content/7/15/eabe4166).

4K 385 74
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