CheMeleon Descriptor-based Foundation Model (Chemrop 2.2.1)
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| Test set | Target label | Metric | Score |
|---|---|---|---|
| test | CLS_KIT | f1 | 0.5 |
| test | CLS_KIT | mcc | 0.47819502975103756 |
| test | CLS_KIT | pr_auc | 0.6458956258510183 |
| test | CLS_KIT | roc_auc | 0.8225338491295938 |
| test | CLS_KIT | accuracy | 0.8620689655172413 |
| test | CLS_KIT | cohen_kappa | 0.432762836185819 |