MACCS, ESM with single position and simple MLP
| Test set | Target label | Metric | Score |
|---|---|---|---|
| test | CLASS_KIT | f1 | 0.5925925925925926 |
| test | CLASS_KIT | mcc | 0.4447763748037876 |
| test | CLASS_KIT | pr_auc | 0.6868990732970949 |
| test | CLASS_KIT | roc_auc | 0.829405162738496 |
| test | CLASS_KIT | accuracy | 0.7471264367816092 |
| test | CLASS_KIT | cohen_kappa | 0.4221014492753623 |
| test | CLASS_KIT_(T6701_mutant) | f1 | 0.09523809523809523 |
| test | CLASS_KIT_(T6701_mutant) | mcc | -0.014540295200310102 |
| test | CLASS_KIT_(T6701_mutant) | pr_auc | 0.3127287715944322 |
| test | CLASS_KIT_(T6701_mutant) | roc_auc | 0.7651663405088063 |
| test | CLASS_KIT_(T6701_mutant) | accuracy | 0.7816091954022989 |
| test | CLASS_KIT_(T6701_mutant) | cohen_kappa | -0.013488657265481319 |
| test | CLASS_KIT_(V560G_mutant) | f1 | 0.2857142857142857 |
| test | CLASS_KIT_(V560G_mutant) | mcc | 0.1924870958045813 |
| test | CLASS_KIT_(V560G_mutant) | pr_auc | 0.456942456912031 |
| test | CLASS_KIT_(V560G_mutant) | roc_auc | 0.8588888888888889 |
| test | CLASS_KIT_(V560G_mutant) | accuracy | 0.8275862068965517 |
| test | CLASS_KIT_(V560G_mutant) | cohen_kappa | 0.1899441340782123 |
