EarthMetabolomeInitiative/lots-of-smiles
Lots of SMILES: a large deduplicated collection of real-world SMILES Lots of SMILES (LOS) is a single corpus of 15,260,616,134 unique, canonical SMILES strings, assembled by merging and deduplicating three large public molecular collections: PubChem, ZINC20, and the Enamine REAL™ Database. Every record is a single SMILES string, with no catalogue identifiers, prices, computed properties, building blocks, synthons, or source labels. This structure-only design keeps the corpus… See the full description on the dataset page: https://huggingface.co/datasets/EarthMetabolomeInitiative/lots-of-smiles.
| Author / organization | EarthMetabolomeInitiative |
|---|---|
| License (as declared) | cc-by-4.0 |
| Downloads | 142 (as reported by Hugging Face) |
| Likes | 0 |
| Created | 22 June 2026 |
| Last updated at source | 22 June 2026 |
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