docking boosting fingerprinting pruned
| Test set | Target label | Metric | Score |
|---|---|---|---|
| test | CLASS_KIT | f1 | 0.5964912280701754 |
| test | CLASS_KIT | mcc | 0.4185303837382975 |
| test | CLASS_KIT | pr_auc | 0.7231548783472286 |
| test | CLASS_KIT | roc_auc | 0.8327721661054994 |
| test | CLASS_KIT | accuracy | 0.735632183908046 |
| test | CLASS_KIT | cohen_kappa | 0.4071111111111112 |
| test | CLASS_KIT_(T6701_mutant) | f1 | 0.5714285714285714 |
| test | CLASS_KIT_(T6701_mutant) | mcc | 0.4892367906066536 |
| test | CLASS_KIT_(T6701_mutant) | pr_auc | 0.6324142041533345 |
| test | CLASS_KIT_(T6701_mutant) | roc_auc | 0.8091976516634051 |
| test | CLASS_KIT_(T6701_mutant) | accuracy | 0.8620689655172413 |
| test | CLASS_KIT_(T6701_mutant) | cohen_kappa | 0.4892367906066536 |
| test | CLASS_KIT_(V560G_mutant) | f1 | 0.5 |
| test | CLASS_KIT_(V560G_mutant) | mcc | 0.41523235717819634 |
| test | CLASS_KIT_(V560G_mutant) | pr_auc | 0.6963447398190046 |
| test | CLASS_KIT_(V560G_mutant) | roc_auc | 0.8744444444444445 |
| test | CLASS_KIT_(V560G_mutant) | accuracy | 0.8160919540229885 |
| test | CLASS_KIT_(V560G_mutant) | cohen_kappa | 0.39583333333333337 |
