Molecular Property Prediction on QM-3D
52.2MAEBaseline (Davies et al., 2023)
Evaluation results
| Method | Links | |
|---|---|---|
| Baseline (Davies et al., 2023)Feature Representation=Full-spectrum or statistical, Learning Protocol=RandomForestRegressor, Number of Folds=52026.06 | 52.2 | |
| tripartite spectral representationFeature Representation=Compressed topological-spectral, Learning Protocol=RandomForestRegressor, Number of Folds=52026.06 | 53.1 |