ChemistryAtlas Dataset

RXNMapper USPTO Benchmark

Reactions and synthesisatom mappingreactionUSPTO
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Reaction atom-mapping benchmark resources used with RXNMapper and USPTO reaction corpora.

Category: Reactions and synthesis.

Citation: Schwaller et al., Sci Adv 2021.

TypeDataset
DomainReactions and synthesis
LicenseMIT license for code; dataset-specific
ContributorsIBM RXN team