ReTiNA / data /additives /README.md
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# 🧪 ReTiNA Table of Additive Desciptors
The ReTiNA dataset is accompanied with Morgan fingerprints for each additive in the
dataset, capturing features for model training. Descriptors were computed using RDKit.
## Topological Descriptors
| Descriptor | Summary | Software Used |
|------------|---------|---------------|
| Morgan_Fingerprint | Circular fingerprints encoding molecular substructures up to a given radius, used for similarity and machine learning | RDKit |