GIRAFFE embeddings with a MLP.
| Test set | Target label | Metric | Score |
|---|---|---|---|
| test | LOG_HLM_CLint | r2 | 0.45472214338221384 |
| test | LOG_HLM_CLint | pearsonr | 0.6868662406571366 |
| test | LOG_HLM_CLint | spearmanr | 0.6629812811152992 |
| test | LOG_HLM_CLint | explained_var | 0.4576370537453537 |
| test | LOG_HLM_CLint | mean_squared_error | 0.2203370421660538 |
| test | LOG_HLM_CLint | mean_absolute_error | 0.3607620921927877 |
| test | LOG_HPPB | r2 | 0.5560861938173174 |
| test | LOG_HPPB | pearsonr | 0.749006327147117 |
| test | LOG_HPPB | spearmanr | 0.7665977986314605 |
| test | LOG_HPPB | explained_var | 0.5571522323416512 |
| test | LOG_HPPB | mean_squared_error | 0.31648637671654767 |
| test | LOG_HPPB | mean_absolute_error | 0.40432464653440114 |
| test | LOG_MDR1-MDCK_ER | r2 | 0.5774357376710695 |
| test | LOG_MDR1-MDCK_ER | pearsonr | 0.7606705777431806 |
| test | LOG_MDR1-MDCK_ER | spearmanr | 0.7860920114418928 |
| test | LOG_MDR1-MDCK_ER | explained_var | 0.5781360364422654 |
| test | LOG_MDR1-MDCK_ER | mean_squared_error | 0.20309360753897643 |
| test | LOG_MDR1-MDCK_ER | mean_absolute_error | 0.34576252501611604 |
| test | LOG_RLM_CLint | r2 | 0.4482053693999264 |
| test | LOG_RLM_CLint | pearsonr | 0.6873375556278978 |
| test | LOG_RLM_CLint | spearmanr | 0.6927788536801205 |
| test | LOG_RLM_CLint | explained_var | 0.44869665116757995 |
| test | LOG_RLM_CLint | mean_squared_error | 0.3013089266449428 |
| test | LOG_RLM_CLint | mean_absolute_error | 0.41901788964414594 |
| test | LOG_RPPB | r2 | 0.45716744536401177 |
| test | LOG_RPPB | pearsonr | 0.6855331050096483 |
| test | LOG_RPPB | spearmanr | 0.6590592334494775 |
| test | LOG_RPPB | explained_var | 0.4648658382105678 |
| test | LOG_RPPB | mean_squared_error | 0.2672241585562521 |
| test | LOG_RPPB | mean_absolute_error | 0.4071033140486876 |
| test | LOG_SOLUBILITY | r2 | 0.3601339582103499 |
| test | LOG_SOLUBILITY | pearsonr | 0.6107104665225622 |
| test | LOG_SOLUBILITY | spearmanr | 0.5231625632949214 |
| test | LOG_SOLUBILITY | explained_var | 0.3669046539132681 |
| test | LOG_SOLUBILITY | mean_squared_error | 0.29766437898399606 |
| test | LOG_SOLUBILITY | mean_absolute_error | 0.38877038580110124 |
