GIRAFFE embeddings with a MLP.
| Test set | Target label | Metric | Score |
|---|---|---|---|
| test | LOG_HLM_CLint | r2 | 0.3755886080615759 |
| test | LOG_HLM_CLint | pearsonr | 0.626185933656669 |
| test | LOG_HLM_CLint | spearmanr | 0.6320599702804484 |
| test | LOG_HLM_CLint | explained_var | 0.3841008946843085 |
| test | LOG_HLM_CLint | mean_squared_error | 0.2523134903146059 |
| test | LOG_HLM_CLint | mean_absolute_error | 0.388575115590161 |
| test | LOG_HPPB | r2 | 0.6181206994627382 |
| test | LOG_HPPB | pearsonr | 0.7990027951878156 |
| test | LOG_HPPB | spearmanr | 0.7904036514288655 |
| test | LOG_HPPB | explained_var | 0.6214627453628414 |
| test | LOG_HPPB | mean_squared_error | 0.27225915140911516 |
| test | LOG_HPPB | mean_absolute_error | 0.3993886594257403 |
| test | LOG_MDR1-MDCK_ER | r2 | 0.5206025814526651 |
| test | LOG_MDR1-MDCK_ER | pearsonr | 0.7216772312975668 |
| test | LOG_MDR1-MDCK_ER | spearmanr | 0.7417541060002112 |
| test | LOG_MDR1-MDCK_ER | explained_var | 0.520637963391432 |
| test | LOG_MDR1-MDCK_ER | mean_squared_error | 0.2304088628816943 |
| test | LOG_MDR1-MDCK_ER | mean_absolute_error | 0.3741213879603451 |
| test | LOG_RLM_CLint | r2 | 0.3861100988720957 |
| test | LOG_RLM_CLint | pearsonr | 0.6494840748719903 |
| test | LOG_RLM_CLint | spearmanr | 0.6597166252617409 |
| test | LOG_RLM_CLint | explained_var | 0.40726496712278104 |
| test | LOG_RLM_CLint | mean_squared_error | 0.3352162143837183 |
| test | LOG_RLM_CLint | mean_absolute_error | 0.46352951256347363 |
| test | LOG_RPPB | r2 | 0.6420247611798979 |
| test | LOG_RPPB | pearsonr | 0.802567673879334 |
| test | LOG_RPPB | spearmanr | 0.7891986062717772 |
| test | LOG_RPPB | explained_var | 0.642314418289101 |
| test | LOG_RPPB | mean_squared_error | 0.1762230934027574 |
| test | LOG_RPPB | mean_absolute_error | 0.3298526820090375 |
| test | LOG_SOLUBILITY | r2 | 0.2975311542962207 |
| test | LOG_SOLUBILITY | pearsonr | 0.556836217594723 |
| test | LOG_SOLUBILITY | spearmanr | 0.5421453934920175 |
| test | LOG_SOLUBILITY | explained_var | 0.3076700570082642 |
| test | LOG_SOLUBILITY | mean_squared_error | 0.32678707581853467 |
| test | LOG_SOLUBILITY | mean_absolute_error | 0.3977861886540431 |
