ECFP fingerprints with a xgboost of Group 19
| Test set | Target label | Metric | Score |
|---|---|---|---|
| test | CLASS_KIT | f1 | 0.3829787234042553 |
| test | CLASS_KIT | mcc | 0.23786236610410272 |
| test | CLASS_KIT | pr_auc | 0.6378490252562606 |
| test | CLASS_KIT | roc_auc | 0.7592592592592592 |
| test | CLASS_KIT | accuracy | 0.6666666666666666 |
| test | CLASS_KIT | cohen_kappa | 0.20284360189573458 |
| test | CLASS_KIT_(T6701_mutant) | f1 | 0.4444444444444445 |
| test | CLASS_KIT_(T6701_mutant) | mcc | 0.5012892157197298 |
| test | CLASS_KIT_(T6701_mutant) | pr_auc | 0.671787873159544 |
| test | CLASS_KIT_(T6701_mutant) | roc_auc | 0.7309197651663405 |
| test | CLASS_KIT_(T6701_mutant) | accuracy | 0.8850574712643678 |
| test | CLASS_KIT_(T6701_mutant) | cohen_kappa | 0.4016506189821183 |
| test | CLASS_KIT_(V560G_mutant) | f1 | 0.14285714285714285 |
| test | CLASS_KIT_(V560G_mutant) | mcc | 0.1610626476579478 |
| test | CLASS_KIT_(V560G_mutant) | pr_auc | 0.44141516610188286 |
| test | CLASS_KIT_(V560G_mutant) | roc_auc | 0.7688888888888888 |
| test | CLASS_KIT_(V560G_mutant) | accuracy | 0.8620689655172413 |
| test | CLASS_KIT_(V560G_mutant) | cohen_kappa | 0.10769230769230764 |
