On the Trade-off between Over-smoothing and Over-squashing in Deep Graph Neural Networks

December 05, 2022 ยท Declared Dead ยท ๐Ÿ› International Conference on Information and Knowledge Management

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Authors Jhony H. Giraldo, Konstantinos Skianis, Thierry Bouwmans, Fragkiskos D. Malliaros arXiv ID 2212.02374 Category cs.LG: Machine Learning Cross-listed cs.AI Citations 87 Venue International Conference on Information and Knowledge Management Last Checked 3 months ago
Abstract
Graph Neural Networks (GNNs) have succeeded in various computer science applications, yet deep GNNs underperform their shallow counterparts despite deep learning's success in other domains. Over-smoothing and over-squashing are key challenges when stacking graph convolutional layers, hindering deep representation learning and information propagation from distant nodes. Our work reveals that over-smoothing and over-squashing are intrinsically related to the spectral gap of the graph Laplacian, resulting in an inevitable trade-off between these two issues, as they cannot be alleviated simultaneously. To achieve a suitable compromise, we propose adding and removing edges as a viable approach. We introduce the Stochastic Jost and Liu Curvature Rewiring (SJLR) algorithm, which is computationally efficient and preserves fundamental properties compared to previous curvature-based methods. Unlike existing approaches, SJLR performs edge addition and removal during GNN training while maintaining the graph unchanged during testing. Comprehensive comparisons demonstrate SJLR's competitive performance in addressing over-smoothing and over-squashing.
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