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Less is More: on the Over-Globalizing Problem in Graph Transformers

ICML 2024 · Graph learning › Graph self-supervised learning · approach: Semi-supervised node representation learning · 9 citations (OpenAlex)

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Identifies an over-globalizing problem in node-level Graph Transformers and proposes CoBFormer, which pairs METIS-based bi-level (intra/inter-cluster) global attention with a GCN and mutual-supervision collaborative training.

Problem

Global attention in Graph Transformers over-allocates attention to distant higher-order nodes while near, more informative nodes are weakened, hurting node classification on homophilic graphs.

Approach

Partition the graph with METIS and decouple attention into an intra-cluster Transformer and an inter-cluster Transformer over cluster means (approximating global attention), combined with a GCN trained by a collaborative loss in which each module supervises the other via soft labels.

Key results

Measured effects reported in the paper

What was changedWhereMeasuredEffect
replace vanilla global attention with BGA (ablation)CoBFormer · Coratest accuracy: 54.86 -> 68.72Helped
replace vanilla global attention with BGA (ablation)CoBFormer · PubMedtest accuracy: 71.22 -> 74.52Helped
replace vanilla global attention with BGA (ablation)CoBFormer · Deezertest accuracy: 66.49 -> 66.56No clear effect
add collaborative training (ablation)CoBFormer with vanilla global attention · Coratest accuracy: 54.86 -> 83.82Helped
add collaborative training (ablation)CoBFormer with BGA · Coratest accuracy: 68.72 -> 85.28Helped
add collaborative training (ablation)CoBFormer with vanilla global attention · PubMedtest accuracy: 71.22 -> 80.36Helped
add collaborative training (ablation)CoBFormer with BGA · PubMedtest accuracy: 74.52 -> 81.42Helped
add collaborative training (ablation)CoBFormer with vanilla global attention · Deezertest accuracy: 66.49 -> 66.86Helped
add collaborative training (ablation)CoBFormer with BGA · Deezertest accuracy: 66.56 -> 66.96Helped
replace vanilla global attention with BGA (ablation)CoBFormer · PubMedGPU memory: 8.42G -> 0.50GHelped
replace vanilla global attention with BGA (ablation)CoBFormer · DeezerGPU memory: 20.23G -> 3.97GHelped
double attention scores between same-label nodesVanilla Transformer · CoraAccuracy: 55.18 -> 82.12Helped

Surprising findings

Limitations

Experimental setup

Datasets: Cora CiteSeer PubMed Ogbn-Arxiv Ogbn-Products Actor Deezer

Benchmarks: Cora CiteSeer PubMed Actor Deezer Ogbn-Arxiv Ogbn-Products

Metrics: Micro-F1 Macro-F1 Attn-SNR GPU memory

Baselines: GCN GAT NodeFormer NAGphormer SGFormer

Builds on: NodeFormer SGFormer NAGphormer METIS

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