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USPTO-50k

The USPTO-50k dataset is a curated subset of chemical reaction examples from patent literature, where each reaction is labeled with one of ten reaction classes, focusing on the task of predicting likely reactants for given target compounds.

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Cite this as

Daniel Mark Lowe (2024). Dataset: USPTO-50k. https://doi.org/10.57702/2b3ezpi2

DOI retrieved: November 25, 2024

Additional Info

Field Value
Created November 25, 2024
Last update November 25, 2024
Defined In https://doi.org/10.48550/arXiv.1910.09688
Author Daniel Mark Lowe