DGLGraphTransformer + AttentiveFPModel
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| Test set | Target label | Metric | Score |
|---|---|---|---|
| test | EGFR | r2 | -0.2676839791338017 |
| test | EGFR | pearsonr | 0.430709017881323 |
| test | EGFR | spearmanr | 0.24054972640219918 |
| test | EGFR | explained_var | 0.025000960249952797 |
| test | EGFR | mean_squared_error | 1299.4453725947747 |
| test | EGFR | mean_absolute_error | 20.05296484702342 |
| test | EGFR_(L858R_mutant) | r2 | -0.3107311707391951 |
| test | EGFR_(L858R_mutant) | pearsonr | 0.3741657206810674 |
| test | EGFR_(L858R_mutant) | spearmanr | 0.3051166234727878 |
| test | EGFR_(L858R_mutant) | explained_var | 0.019836697659159963 |
| test | EGFR_(L858R_mutant) | mean_squared_error | 1440.270945109774 |
| test | EGFR_(L858R_mutant) | mean_absolute_error | 21.986334331615552 |