docking boosting fingerprinting pruned and hyperparametered probably overfitted
| Test set | Target label | Metric | Score |
|---|---|---|---|
| test | CLASS_KIT | f1 | 0.5490196078431373 |
| test | CLASS_KIT | mcc | 0.41944009388125153 |
| test | CLASS_KIT | pr_auc | 0.7555430911104951 |
| test | CLASS_KIT | roc_auc | 0.8585858585858587 |
| test | CLASS_KIT | accuracy | 0.735632183908046 |
| test | CLASS_KIT | cohen_kappa | 0.38411819021237303 |
| test | CLASS_KIT_(T6701_mutant) | f1 | 0.5625000000000001 |
| test | CLASS_KIT_(T6701_mutant) | mcc | 0.4713117589242069 |
| test | CLASS_KIT_(T6701_mutant) | pr_auc | 0.6936149191340221 |
| test | CLASS_KIT_(T6701_mutant) | roc_auc | 0.8610567514677103 |
| test | CLASS_KIT_(T6701_mutant) | accuracy | 0.8390804597701149 |
| test | CLASS_KIT_(T6701_mutant) | cohen_kappa | 0.46578947368421053 |
| test | CLASS_KIT_(V560G_mutant) | f1 | 0.6666666666666666 |
| test | CLASS_KIT_(V560G_mutant) | mcc | 0.6133333333333333 |
| test | CLASS_KIT_(V560G_mutant) | pr_auc | 0.665138612310102 |
| test | CLASS_KIT_(V560G_mutant) | roc_auc | 0.8822222222222222 |
| test | CLASS_KIT_(V560G_mutant) | accuracy | 0.9080459770114943 |
| test | CLASS_KIT_(V560G_mutant) | cohen_kappa | 0.6133333333333333 |
