Neural Pairwise Regression with ChemProp Learned Embedding
| Test set | Target label | Metric | Score |
|---|---|---|---|
| test | LOG_RPPB | r2 | 0.5938416379403626 |
| test | LOG_RPPB | pearsonr | 0.7798678270420013 |
| test | LOG_RPPB | spearmanr | 0.8130434782608694 |
| test | LOG_RPPB | explained_var | 0.604456231496062 |
| test | LOG_RPPB | mean_squared_error | 0.3608643878184143 |
| test | LOG_RPPB | mean_absolute_error | 0.4989242943554273 |