Mol2Vec, ESM with single position and simple MLP
| Test set | Target label | Metric | Score |
|---|---|---|---|
| test | CLASS_KIT | f1 | 0.3333333333333333 |
| test | CLASS_KIT | mcc | 0.2789537397603768 |
| test | CLASS_KIT | pr_auc | 0.6426923388424253 |
| test | CLASS_KIT | roc_auc | 0.7615039281705949 |
| test | CLASS_KIT | accuracy | 0.6781609195402298 |
| test | CLASS_KIT | cohen_kappa | 0.20392156862745092 |
| test | CLASS_KIT_(T6701_mutant) | f1 | 0.3333333333333333 |
| test | CLASS_KIT_(T6701_mutant) | mcc | 0.3519324973374816 |
| test | CLASS_KIT_(T6701_mutant) | pr_auc | 0.3514890534775802 |
| test | CLASS_KIT_(T6701_mutant) | roc_auc | 0.7299412915851272 |
| test | CLASS_KIT_(T6701_mutant) | accuracy | 0.8620689655172413 |
| test | CLASS_KIT_(T6701_mutant) | cohen_kappa | 0.2819807427785419 |
| test | CLASS_KIT_(V560G_mutant) | f1 | 0.5 |
| test | CLASS_KIT_(V560G_mutant) | mcc | 0.5488212999484517 |
| test | CLASS_KIT_(V560G_mutant) | pr_auc | 0.5628550935154709 |
| test | CLASS_KIT_(V560G_mutant) | roc_auc | 0.8066666666666666 |
| test | CLASS_KIT_(V560G_mutant) | accuracy | 0.9080459770114943 |
| test | CLASS_KIT_(V560G_mutant) | cohen_kappa | 0.462962962962963 |
