Table 1.
Datasets used for model training, validation, and testing.
| Dataset | Davis | BindingDB |
|---|---|---|
| Proteins | 442 | 509 |
| Compounds | 68 | 4,076 |
| Interactions | 30,056 | 14,505 |
| Training | 25,046 | — |
| Testing | 5010 | 14,505 |
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