ChemistryAtlas Dataset

USPTO-Yields

Reactions and synthesisreactionyieldUSPTO
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Patent reaction yield datasets used for yield prediction and uncertainty-aware reaction modeling.

Category: Reactions and synthesis.

Citation: Schwaller et al., Mach Learn Sci Technol 2021.

TypeDataset
DomainReactions and synthesis
LicenseOpen research dataset
ContributorsSchwaller and IBM RXN team