fingerprints with XGBoost
| Test set | Target label | Metric | Score |
|---|---|---|---|
| test | LOG_SOLUBILITY | r2 | 0.3580293529175014 |
| test | LOG_SOLUBILITY | pearsonr | 0.6006394716950902 |
| test | LOG_SOLUBILITY | spearmanr | 0.4662283126139897 |
| test | LOG_SOLUBILITY | explained_var | 0.3607659221511862 |
| test | LOG_SOLUBILITY | mean_squared_error | 0.34806277236957933 |
| test | LOG_SOLUBILITY | mean_absolute_error | 0.4078240014235767 |
