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Adapted text for new baselines
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docs/baseline.md

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@@ -4,6 +4,8 @@ From the paper to be released soon. Below, you can see the baselines for the `To
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One can observe that the smaller datasets (`Zinc12k` and `Tox21`) beneficiate from adding another unrelated task (`QM9`), where the labels are computed from DFT simulations.
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**NEW baselines added 2023/09/18**: Multitask baselines have been added for GatedGCN and MPNN++ (sum aggretator) using 3 random seeds. They achieve the best performance by a significant margin on Zinc12k and Tox21, while sacrificing a little on QM9.
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| Dataset | Model | MAE ↓ | Pearson ↑ | R² ↑ | MAE ↓ | Pearson ↑ | R² ↑ |
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|-----------|-------|-----------|-----------|-----------|---------|-----------|---------|
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| | <th colspan="3" style="text-align: center;">Single-Task Model</th> <th colspan="3" style="text-align: center;">Multi-Task Model</th> |

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