Mol2Vec, ESM with single position and simple MLP
| Test set | Target label | Metric | Score |
|---|---|---|---|
| test | CLASS_KIT | f1 | 0.11428571428571428 |
| test | CLASS_KIT | mcc | 0.19622098205031857 |
| test | CLASS_KIT | pr_auc | 0.6490900567532281 |
| test | CLASS_KIT | roc_auc | 0.7620650953984287 |
| test | CLASS_KIT | accuracy | 0.6436781609195402 |
| test | CLASS_KIT | cohen_kappa | 0.07415036045314094 |
| test | CLASS_KIT_(T6701_mutant) | f1 | 0 |
| test | CLASS_KIT_(T6701_mutant) | mcc | -0.04722297700467238 |
| test | CLASS_KIT_(T6701_mutant) | pr_auc | 0.37025213233010207 |
| test | CLASS_KIT_(T6701_mutant) | roc_auc | 0.7201565557729941 |
| test | CLASS_KIT_(T6701_mutant) | accuracy | 0.8275862068965517 |
| test | CLASS_KIT_(T6701_mutant) | cohen_kappa | -0.02192638997650742 |
| test | CLASS_KIT_(V560G_mutant) | f1 | 0.15384615384615385 |
| test | CLASS_KIT_(V560G_mutant) | mcc | 0.269581933008596 |
| test | CLASS_KIT_(V560G_mutant) | pr_auc | 0.5764728773500704 |
| test | CLASS_KIT_(V560G_mutant) | roc_auc | 0.7944444444444445 |
| test | CLASS_KIT_(V560G_mutant) | accuracy | 0.8735632183908046 |
| test | CLASS_KIT_(V560G_mutant) | cohen_kappa | 0.1355013550135502 |
