docking boosting fingerprinting pruned
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| Test set | Target label | Metric | Score |
|---|---|---|---|
| test | CLASS_KIT | f1 | 0.5185185185185185 |
| test | CLASS_KIT | mcc | 0.33405950897280184 |
| test | CLASS_KIT | pr_auc | 0.684619059656781 |
| test | CLASS_KIT | roc_auc | 0.8080808080808081 |
| test | CLASS_KIT | accuracy | 0.7011494252873564 |
| test | CLASS_KIT | cohen_kappa | 0.31702898550724645 |
| test | CLASS_KIT_(T6701_mutant) | f1 | 0.6666666666666666 |
| test | CLASS_KIT_(T6701_mutant) | mcc | 0.6267639098606749 |
| test | CLASS_KIT_(T6701_mutant) | pr_auc | 0.6900382330561358 |
| test | CLASS_KIT_(T6701_mutant) | roc_auc | 0.7915851272015656 |
| test | CLASS_KIT_(T6701_mutant) | accuracy | 0.9080459770114943 |
| test | CLASS_KIT_(T6701_mutant) | cohen_kappa | 0.6150442477876106 |
| test | CLASS_KIT_(V560G_mutant) | f1 | 0.64 |
| test | CLASS_KIT_(V560G_mutant) | mcc | 0.5803432921972449 |
| test | CLASS_KIT_(V560G_mutant) | pr_auc | 0.6604093718333317 |
| test | CLASS_KIT_(V560G_mutant) | roc_auc | 0.8655555555555555 |
| test | CLASS_KIT_(V560G_mutant) | accuracy | 0.896551724137931 |
| test | CLASS_KIT_(V560G_mutant) | cohen_kappa | 0.5797101449275363 |