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From Relational Pooling to Subgraph GNNs: A Universal Framework for More Expressive Graph Neural Networks

ICML 2023 · Graph learning › GNN architectures · approach: Substructure-aware GNN expressivity · 1 citations (OpenAlex)

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Measured effects reported in the paper

What was changedWhereMeasuredEffect
Add node ID labels to l nodes (l>=2) to MPNN (ID-MPNN)MPNN · EXP and SR25 graph isomorphismaccuracy: GIN 50 -> 100 on EXP; 6.67 -> 100 on SR25Helped
Add node ID labels (l>=2) to PPGN (ID-PPGN)PPGN · SR25accuracy: 6.67 -> 100Helped
Use ID-MPNN with l=4 instead of standard baselines on ZINC12kMPNN · ZINC12ktest MAE: 4-IDMPNN 0.083 vs GPS 0.070 (best)Mixed
Use 4-IDMPNN on ogbg-molhivMPNN · ogbg-molhivtest AUC: 79.31 vs CIN 80.94Mixed
Use 4-IDMPNN on QM9MPNN · QM9 (12 targets)MAE: superior on 7 of 12 targetsHelped
Restrict ID-MPNN (l = target substructure size) to labeled tuples for substructure countingMPNN · Random regular graph substructure counting (triangle)test MAE: 5.86E-46 vs GIN-AK+ 1.23E-2Helped

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