mlsanityData to 14 Oct 2026

Rethinking the Effectiveness of Graph Classification Datasets in Benchmarks for Assessing GNNs

arXiv 2407.04999 ↗First posted 6 Jul 2024cs.LGcited by 4

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Abstract (arXiv)

Graph classification benchmarks, vital for assessing and developing graph neural networks (GNNs), have recently been scrutinized, as simple methods like MLPs have demonstrated comparable performance. This leads to an important question: Do these benchmarks effectively distinguish the advancements of GNNs over other methodologies? If so, how do we quantitatively measure this effectiveness? In response, we first propose an empirical protocol based on a fair benchmarking framework to investigate the performance discrepancy between simple methods and GNNs. We further propose a novel metric to quantify the dataset effectiveness by considering both dataset complexity and model performance. To the best of our knowledge, our work is the first to thoroughly study and provide an explicit definition for dataset effectiveness in the graph learning area. Through testing across 16 real-world datasets, we found our metric to align with existing studies and intuitive assumptions. Finally, we explore the causes behind the low effectiveness of certain datasets by investigating the correlation between intrinsic graph properties and class labels, and we developed a novel technique supporting the correlation-controllable synthetic dataset generation. Our findings shed light on the current understanding of benchmark datasets, and our new platform could fuel the future evolution of graph classification benchmarks.

Key facts. Cited by 4 papers in the map (data through 14 Oct 2026). Builds on 17 of its 25 references that are in the map. First posted on arXiv 6 Jul 2024.

Builds on

17 of 25 references.

References · 17

  1. 2017Inductive Representation Learning on Large Graphscited by 6,320
  2. 2018How Powerful are Graph Neural Networks?cited by 4,393
  3. 2020Open Graph Benchmark: Datasets for Machine Learning on Graphscited by 2,163
  4. 2020TUDataset: A collection of benchmark datasets for learning with graphscited by 728
  5. 2020Benchmarking Graph Neural Networkscited by 680
  6. 2020Graph Neural Networks in Recommender Systems: A Surveycited by 494
  7. 2020Improving Graph Neural Network Expressivity via Subgraph Isomorphism Countingcited by 313
  8. 2019A Fair Comparison of Graph Neural Networks for Graph Classificationcited by 244
  9. 2020Can Graph Neural Networks Count Substructures?cited by 236
  10. 2022How Powerful are Spectral Graph Neural Networkscited by 169
  11. 2019Relational Pooling for Graph Representationscited by 150
  12. 2022How Powerful are K-hop Message Passing Graph Neural Networkscited by 90
5 more
  1. 2019Learning metrics for persistence-based summaries and applications for graph classificationcited by 57
  2. 2022A Comprehensive Study on Large-Scale Graph Training: Benchmarking and Rethinkingcited by 56
  3. 2021On Positional and Structural Node Features for Graph Neural Networks on Non-attributed Graphscited by 49
  4. 2022Synthetic Graph Generation to Benchmark Graph Learningcited by 16
  5. 2022Are All the Datasets in Benchmark Necessary? A Pilot Study of Dataset Evaluation for Text Classificationcited by 3

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Citing papers per year: 2024: 1; 2025: 3.

4 papers.