Towards Understanding the Generalization of Graph Neural Networks
Not on the map. Why?
Abstract (arXiv)
Graph neural networks (GNNs) are the most widely adopted model in graph-structured data oriented learning and representation. Despite their extraordinary success in real-world applications, understanding their working mechanism by theory is still on primary stage. In this paper, we move towards this goal from the perspective of generalization. To be specific, we first establish high probability bounds of generalization gap and gradients in transductive learning with consideration of stochastic optimization. After that, we provide high probability bounds of generalization gap for popular GNNs. The theoretical results reveal the architecture specific factors affecting the generalization gap. Experimental results on benchmark datasets show the consistency between theoretical results and empirical evidence. Our results provide new insights in understanding the generalization of GNNs.
Key facts. Cited by 41 papers in the map (data through 7 Oct 2026). Builds on 73 of its 99 references that are in the map. First posted on arXiv 14 May 2023.
Builds on
73 of 99 references.
References · 73
- 2014Adam: A Method for Stochastic Optimizationcited by 36,960
- 2016Semi-Supervised Classification with Graph Convolutional Networkscited by 11,282
- 2017Graph Attention Networkscited by 8,854
- 2017Inductive Representation Learning on Large Graphscited by 6,284
- 2018How Powerful are Graph Neural Networks?cited by 4,355
- 2019A Comprehensive Survey on Graph Neural Networkscited by 2,906
- 2018Neural Tangent Kernel: Convergence and Generalization in Neural Networkscited by 2,597
- 2019Fast Graph Representation Learning with PyTorch Geometriccited by 2,414
- 2018Graph Neural Networks: A Review of Methods and Applicationscited by 1,571
- 2019Simplifying Graph Convolutional Networkscited by 1,470
- 2020LightGCN: Simplifying and Powering Graph Convolution Network for Recommendationcited by 1,134
- 2018Graph Convolutional Neural Networks for Web-Scale Recommender Systemscited by 1,133
38 more
- 2018Deeper Insights into Graph Convolutional Networks for Semi-Supervised Learningcited by 1,099
- 2018Predict then Propagate: Graph Neural Networks meet Personalized PageRankcited by 987
- 2016Revisiting Semi-Supervised Learning with Graph Embeddingscited by 970
- 2018Representation Learning on Graphs with Jumping Knowledge Networkscited by 875
- 2020Learning to Simulate Complex Physics with Graph Networkscited by 867
- 2020Simple and Deep Graph Convolutional Networkscited by 857
- 2020Learning Mesh-Based Simulation with Graph Networkscited by 840
- 2019GNNExplainer: Generating Explanations for Graph Neural Networkscited by 735
- 2019Graph Neural Networks for Social Recommendationcited by 711
- 2019DropEdge: Towards Deep Graph Convolutional Networks on Node Classificationcited by 679
- 2019GraphSAINT: Graph Sampling Based Inductive Learning Methodcited by 618
- 2020Adaptive Universal Generalized PageRank Graph Neural Networkcited by 592
- 2015Train faster, generalize better: Stability of stochastic gradient descentcited by 547
- 2020Parameterized Explainer for Graph Neural Networkcited by 423
- 2018Lipschitz regularity of deep neural networks: analysis and efficient estimationcited by 413
- 2018Deep Learning on Graphs: A Surveycited by 393
- 2017Large-scale Point Cloud Semantic Segmentation with Superpoint Graphscited by 384
- 2018Invariant and Equivariant Graph Networkscited by 339
- 2017Few-Shot Learning with Graph Neural Networkscited by 324
- 2018Image Generation from Scene Graphscited by 324
- 2019PairNorm: Tackling Oversmoothing in GNNscited by 297
- 2019Efficient and Accurate Estimation of Lipschitz Constants for Deep Neural Networkscited by 290
- 2021On Explainability of Graph Neural Networks via Subgraph Explorationscited by 280
- 2020How Neural Networks Extrapolate: From Feedforward to Graph Neural Networkscited by 218
- 2020Generalization and Representational Limits of Graph Neural Networkscited by 217
- 2020XGNN: Towards Model-Level Explanations of Graph Neural Networkscited by 211
- 2020PGM-Explainer: Probabilistic Graphical Model Explanations for Graph Neural Networkscited by 210
- 2021BernNet: Learning Arbitrary Graph Spectral Filters via Bernstein Approximationcited by 195
- 2019On the equivalence between graph isomorphism testing and function approximation with GNNscited by 172
- 2022Handling Distribution Shifts on Graphs: An Invariance Perspectivecited by 163
- 2019Graph Neural Tangent Kernel: Fusing Graph Neural Networks with Graph Kernelscited by 160
- 2019What Can Neural Networks Reason About?cited by 155
- 2020From Local Structures to Size Generalization in Graph Neural Networkscited by 119
- 2022Out-Of-Distribution Generalization on Graphs: A Surveycited by 97
- 2022Decoupling the Depth and Scope of Graph Neural Networkscited by 94
- 2018On the Convergence of Adaptive Gradient Methods for Nonconvex Optimizationcited by 91
- 2017Data-Dependent Stability of Stochastic Gradient Descentcited by 90
- 2022How Powerful are K-hop Message Passing Graph Neural Networkscited by 90
50 most cited of 73 All 73 (JSON)
Built on by
Citing papers per year: 2023: 2; 2024: 18; 2025: 16; 2026: 5.
41 papers.
Sort:
By area:
- 2024GFT: Graph Foundation Model with Transferable Tree Vocabularycited by 82
- 2025Beyond Message Passing: Neural Graph Pattern Machinecited by 17
- 2024A Manifold Perspective on the Statistical Generalization of Graph Neural Networkscited by 16
- 2024What Improves the Generalization of Graph Transformers? A Theoretical Dive into the Self-attention and Positional Encodingcited by 14
- 2024Towards Bridging Generalization and Expressivity of Graph Neural Networkscited by 12
- 2024Graph Classification via Reference Distribution Learning: Theory and Practicecited by 11
- 2024Generalization of Geometric Graph Neural Networks with Lipschitz Loss Functionscited by 6
- 2024Deeper Insights into Deep Graph Convolutional Networks: Stability and Generalizationcited by 6
- 2024Future Directions in the Theory of Graph Machine Learningcited by 5
- 2024TEDDY: Trimming Edges with Degree-based Discrimination strategYcited by 4
- 2024Generalization Error of Graph Neural Networks in the Mean-field Regimecited by 4
- 2024Asymptotic generalization error of a single-layer graph convolutional networkcited by 3
29 more
- 2024Foundations and Frontiers of Graph Learning Theorycited by 3
- 2024Generalization capabilities of MeshGraphNets to unseen geometries for fluid dynamicscited by 3
- 2023Perfect Alignment May be Poisonous to Graph Contrastive Learningcited by 2
- 2023Information-Theoretic Generalization Bounds for Transductive Learning and its Applicationscited by 2
- 2024Graph Neural Network Generalization with Gaussian Mixture Model Based Augmentationcited by 2
- 2024Making Classic GNNs Strong Baselines Across Varying Homophily: A Smoothness-Generalization Perspectivecited by 2
- 2025Statistical physics analysis of graph neural networks: Approaching optimality in the contextual stochastic block modelcited by 2
- 2025Understanding Generalization in Node and Link Predictioncited by 2
- 2025On the Interplay between Graph Structure and Learning Algorithms in Graph Neural Networkscited by 2
- 2024When narrower is better: the narrow width limit of Bayesian parallel branching neural networkscited by 1
- 2025Tuning Algorithmic and Architectural Hyperparameters in Graph-Based Semi-Supervised Learning with Provable Guaranteescited by 1
- 2025MAPN: Enhancing Heterogeneous Sparse Graph Representation by Mamba-based Asynchronous Aggregationcited by 1
- 2025A Note on Graphon-Signal Analysis of Graph Neural Networkscited by 1
- 2025Estimating Heterogeneous Causal Effect on Networks via Orthogonal Learningcited by 1
- 2026SCL-GNN: Towards Generalizable Graph Neural Networks via Spurious Correlation Learningcited by 1
- 2024Generalization of Graph Neural Networks through the Lens of Homomorphismcited by 0
- 2024Optimal Exact Recovery in Semi-Supervised Learning: A Study of Spectral Methods and Graph Convolutional Networkscited by 0
- 2025UPL: Uncertainty-aware Pseudo-labeling for Imbalance Transductive Node Classificationcited by 0
- 2025Efficient Data Selection for Training Genomic Perturbation Modelscited by 0
- 2025Theoretical Learning Performance of Graph Neural Networks: The Impact of Jumping Connections and Layer-wise Sparsificationcited by 0
- 2025Memorization in Graph Neural Networkscited by 0
- 2025PAC-Bayesian Generalization Bounds for Graph Convolutional Networks on Inductive Node Classificationcited by 0
- 2025Exact Generalisation Error Exposes Benchmarks Skew Graph Neural Networks Success (or Failure)cited by 0
- 2025On Local Limits of Sparse Random Graphs: Color Convergence and the Refined Configuration Modelcited by 0
- 2025Resource Allocation in Hybrid Radio-Optical IoT Networks using GNN with Multi-task Learningcited by 0
- 2026Graph Learning Should Move Beyond Restrictive Views of Spectral and Message-Passing GNNscited by 0
- 2026Transductive Generalization via Optimal Transport and Its Application to Graph Node Classificationcited by 0
- 2026Rethinking Generalization in Graph Neural Networks: A Structural Complexity Perspectivecited by 0
- 2026Local-Global Geometric Insights for Graph Neural Networks via Entropic Curvaturecited by 0
- 2026Local-Global Geometric Insights for Graph Neural Networks via Entropic Curvature24 Jul 2026
- 2026Rethinking Generalization in Graph Neural Networks: A Structural Complexity Perspective13 May 2026
- 2026Transductive Generalization via Optimal Transport and Its Application to Graph Node Classification10 Mar 2026
- 2026SCL-GNN: Towards Generalizable Graph Neural Networks via Spurious Correlation Learning9 Mar 2026
- 2026Graph Learning Should Move Beyond Restrictive Views of Spectral and Message-Passing GNNs10 Feb 2026
- 2025Resource Allocation in Hybrid Radio-Optical IoT Networks using GNN with Multi-task Learning29 Oct 2025
- 2025On Local Limits of Sparse Random Graphs: Color Convergence and the Refined Configuration Model24 Oct 2025
- 2025Estimating Heterogeneous Causal Effect on Networks via Orthogonal Learning23 Sep 2025
- 2025Exact Generalisation Error Exposes Benchmarks Skew Graph Neural Networks Success (or Failure)12 Sep 2025
- 2025PAC-Bayesian Generalization Bounds for Graph Convolutional Networks on Inductive Node Classification8 Sep 2025
- 2025Memorization in Graph Neural Networks26 Aug 2025
- 2025A Note on Graphon-Signal Analysis of Graph Neural Networks25 Aug 2025
29 more
- 2025On the Interplay between Graph Structure and Learning Algorithms in Graph Neural Networks20 Aug 2025
- 2025Theoretical Learning Performance of Graph Neural Networks: The Impact of Jumping Connections and Layer-wise Sparsification7 Jul 2025
- 2025Understanding Generalization in Node and Link Prediction1 Jul 2025
- 2025Efficient Data Selection for Training Genomic Perturbation Models18 Mar 2025
- 2025Statistical physics analysis of graph neural networks: Approaching optimality in the contextual stochastic block model3 Mar 2025
- 2025MAPN: Enhancing Heterogeneous Sparse Graph Representation by Mamba-based Asynchronous Aggregation23 Feb 2025
- 2025Tuning Algorithmic and Architectural Hyperparameters in Graph-Based Semi-Supervised Learning with Provable Guarantees18 Feb 2025
- 2025UPL: Uncertainty-aware Pseudo-labeling for Imbalance Transductive Node Classification2 Feb 2025
- 2025Beyond Message Passing: Neural Graph Pattern Machine30 Jan 2025
- 2024Optimal Exact Recovery in Semi-Supervised Learning: A Study of Spectral Methods and Graph Convolutional Networks18 Dec 2024
- 2024Making Classic GNNs Strong Baselines Across Varying Homophily: A Smoothness-Generalization Perspective13 Dec 2024
- 2024Graph Neural Network Generalization with Gaussian Mixture Model Based Augmentation13 Nov 2024
- 2024GFT: Graph Foundation Model with Transferable Tree Vocabulary9 Nov 2024
- 2024Towards Bridging Generalization and Expressivity of Graph Neural Networks14 Oct 2024
- 2024Deeper Insights into Deep Graph Convolutional Networks: Stability and Generalization11 Oct 2024
- 2024Generalization of Geometric Graph Neural Networks with Lipschitz Loss Functions8 Sep 2024
- 2024Graph Classification via Reference Distribution Learning: Theory and Practice21 Aug 2024
- 2024Generalization capabilities of MeshGraphNets to unseen geometries for fluid dynamics12 Aug 2024
- 2024When narrower is better: the narrow width limit of Bayesian parallel branching neural networks26 Jul 2024
- 2024Foundations and Frontiers of Graph Learning Theory3 Jul 2024
- 2024A Manifold Perspective on the Statistical Generalization of Graph Neural Networks7 Jun 2024
- 2024What Improves the Generalization of Graph Transformers? A Theoretical Dive into the Self-attention and Positional Encoding4 Jun 2024
- 2024Generalization of Graph Neural Networks through the Lens of Homomorphism10 Mar 2024
- 2024Generalization Error of Graph Neural Networks in the Mean-field Regime10 Feb 2024
- 2024Asymptotic generalization error of a single-layer graph convolutional network6 Feb 2024
- 2024Future Directions in the Theory of Graph Machine Learning3 Feb 2024
- 2024TEDDY: Trimming Edges with Degree-based Discrimination strategY2 Feb 2024
- 2023Information-Theoretic Generalization Bounds for Transductive Learning and its Applications8 Nov 2023
- 2023Perfect Alignment May be Poisonous to Graph Contrastive Learning6 Oct 2023
- 2024GFT: Graph Foundation Model with Transferable Tree Vocabularycited by 82
- 2025Beyond Message Passing: Neural Graph Pattern Machinecited by 17
- 2024A Manifold Perspective on the Statistical Generalization of Graph Neural Networkscited by 16
- 2024What Improves the Generalization of Graph Transformers? A Theoretical Dive into the Self-attention and Positional Encodingcited by 14
- 2024Towards Bridging Generalization and Expressivity of Graph Neural Networkscited by 12
- 2024Graph Classification via Reference Distribution Learning: Theory and Practicecited by 11
- 2024Generalization of Geometric Graph Neural Networks with Lipschitz Loss Functionscited by 6
- 2024Deeper Insights into Deep Graph Convolutional Networks: Stability and Generalizationcited by 6
- 2024Future Directions in the Theory of Graph Machine Learningcited by 5
- 2024TEDDY: Trimming Edges with Degree-based Discrimination strategYcited by 4
- 2024Generalization Error of Graph Neural Networks in the Mean-field Regimecited by 4
- 2024Asymptotic generalization error of a single-layer graph convolutional networkcited by 3
12 most cited of 40 All 40 (JSON)
- 2026Local-Global Geometric Insights for Graph Neural Networks via Entropic Curvature24 Jul 2026
- 2026Rethinking Generalization in Graph Neural Networks: A Structural Complexity Perspective13 May 2026
- 2026Transductive Generalization via Optimal Transport and Its Application to Graph Node Classification10 Mar 2026
- 2026SCL-GNN: Towards Generalizable Graph Neural Networks via Spurious Correlation Learning9 Mar 2026
- 2026Graph Learning Should Move Beyond Restrictive Views of Spectral and Message-Passing GNNs10 Feb 2026
- 2025Resource Allocation in Hybrid Radio-Optical IoT Networks using GNN with Multi-task Learning29 Oct 2025
- 2025On Local Limits of Sparse Random Graphs: Color Convergence and the Refined Configuration Model24 Oct 2025
- 2025Estimating Heterogeneous Causal Effect on Networks via Orthogonal Learning23 Sep 2025
- 2025Exact Generalisation Error Exposes Benchmarks Skew Graph Neural Networks Success (or Failure)12 Sep 2025
- 2025PAC-Bayesian Generalization Bounds for Graph Convolutional Networks on Inductive Node Classification8 Sep 2025
- 2025Memorization in Graph Neural Networks26 Aug 2025
- 2025A Note on Graphon-Signal Analysis of Graph Neural Networks25 Aug 2025
12 newest of 40 All 40 (JSON)