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Rethinking Explaining Graph Neural Networks via Non-parametric Subgraph Matching

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The success of graph neural networks (GNNs) provokes the question about explainability: ``Which fraction of the input graph is the most determinant of the prediction?'' Particularly, parametric explainers prevail in existing approaches because of their more robust capability to decipher the black-box (i.e., target GNNs). In this paper, based on the observation that graphs typically share some common motif patterns, we propose a novel non-parametric subgraph matching framework, dubbed MatchExplainer, to explore explanatory subgraphs. It couples the target graph with other counterpart instances and identifies the most crucial joint substructure by minimizing the node corresponding-based distance. Moreover, we note that present graph sampling or node-dropping methods usually suffer from the false positive sampling problem. To alleviate this issue, we designed a new augmentation paradigm named MatchDrop. It takes advantage of MatchExplainer to fix the most informative portion of the graph and merely operates graph augmentations on the rest less informative part. Extensive experiments on synthetic and real-world datasets show the effectiveness of our MatchExplainer by outperforming all state-of-the-art parametric baselines with significant margins. Results also demonstrate that MatchDrop is a general scheme to be equipped with GNNs for enhanced performance. The code is available at: https://github.com/smiles724/MatchExplainer.

Fang Wu, Siyuan Li, Xurui Jin, Yinghui Jiang, Dragomir Radev, Zhangming Niu, Stan Z. Li• 2023

Related benchmarks

TaskDatasetResultRank
Graph ClassificationFluorid-Carbonyl MultipleMotif (test)
AUC-ROC77.9
9
Graph ClassificationBA-2motifs SingleMotif (test)
AUC-ROC0.802
9
Graph ClassificationBA-HouseAndGrid MultipleMotif (test)
AUC-ROC77.3
9
Graph ClassificationBA-HouseGrid SingleMotif (test)
AUC-ROC0.757
9
Graph ClassificationAlkane-Carbonyl MultipleMotif (test)
AUC-ROC60.3
9
Graph ClassificationBenzene MultipleMotif (test)
AUC-ROC51.2
9
Graph ClassificationSPMotif SingleMotif (test)
AUC-ROC49.9
9
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