Prediction-level late fusion of 5 models (D-MPNN & MoLFormer MTL + CheMeleon, GraphMVP, MAP STL), uniform-mean ensemble, seed-averaged predictions.
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| Test set | Target label | Metric | Score |
|---|---|---|---|
| test | LOG_RLM_CLint | r2 | 0.6386365620056371 |
| test | LOG_RLM_CLint | pearsonr | 0.8033058868222407 |
| test | LOG_RLM_CLint | spearmanr | 0.8067742616421526 |
| test | LOG_RLM_CLint | explained_var | 0.6389528123575924 |
| test | LOG_RLM_CLint | mean_squared_error | 0.20400531357891552 |
| test | LOG_RLM_CLint | mean_absolute_error | 0.3563935377183148 |