# Graphtester: Exploring Theoretical Boundaries of GNNs on Graph Datasets

arXiv: https://arxiv.org/abs/2306.17482 · HTML: https://mlsanity.com/paper/2306.17482/

## Key facts

- Cited by 3 papers in the map (data through 14 Oct 2026).
- Builds on 29 of its 48 references that are in the map.
- First posted on arXiv 30 Jun 2023.

## Builds on (most cited first, 29 of 29)

- [Attention Is All You Need](https://mlsanity.com/paper/1706.03762/) (2017)
- [Semi-Supervised Classification with Graph Convolutional Networks](https://mlsanity.com/paper/1609.02907/) (2016)
- [Graph Attention Networks](https://mlsanity.com/paper/1710.10903/) (2017)
- [Inductive Representation Learning on Large Graphs](https://mlsanity.com/paper/1706.02216/) (2017)
- [How Powerful are Graph Neural Networks?](https://mlsanity.com/paper/1810.00826/) (2018)
- [A Comprehensive Survey on Graph Neural Networks](https://mlsanity.com/paper/1901.00596/) (2019)
- [Fast Graph Representation Learning with PyTorch Geometric](https://mlsanity.com/paper/1903.02428/) (2019)
- [Open Graph Benchmark: Datasets for Machine Learning on Graphs](https://mlsanity.com/paper/2005.00687/) (2020)
- [Modeling Relational Data with Graph Convolutional Networks](https://mlsanity.com/paper/1703.06103/) (2017)
- [Geometric deep learning: going beyond Euclidean data](https://mlsanity.com/paper/1611.08097/) (2016)
- [Pitfalls of Graph Neural Network Evaluation](https://mlsanity.com/paper/1811.05868/) (2018)
- [Strategies for Pre-training Graph Neural Networks](https://mlsanity.com/paper/1905.12265/) (2019)
- [Weisfeiler and Leman Go Neural: Higher-order Graph Neural Networks](https://mlsanity.com/paper/1810.02244/) (2018)
- [Convolutional Networks on Graphs for Learning Molecular Fingerprints](https://mlsanity.com/paper/1509.09292/) (2015)
- [TUDataset: A collection of benchmark datasets for learning with graphs](https://mlsanity.com/paper/2007.08663/) (2020)
- [Recipe for a General, Powerful, Scalable Graph Transformer](https://mlsanity.com/paper/2205.12454/) (2022)
- [Image-based Recommendations on Styles and Substitutes](https://mlsanity.com/paper/1506.04757/) (2015)
- [Benchmarking Graph Neural Networks](https://mlsanity.com/paper/2003.00982/) (2020)
- [A Generalization of Transformer Networks to Graphs](https://mlsanity.com/paper/2012.09699/) (2020)
- [Rethinking Graph Transformers with Spectral Attention](https://mlsanity.com/paper/2106.03893/) (2021)
- [Provably Powerful Graph Networks](https://mlsanity.com/paper/1905.11136/) (2019)
- [Graph Neural Networks with Learnable Structural and Positional Representations](https://mlsanity.com/paper/2110.07875/) (2021)
- [Improving Graph Neural Network Expressivity via Subgraph Isomorphism Counting](https://mlsanity.com/paper/2006.09252/) (2020)
- [Can Graph Neural Networks Count Substructures?](https://mlsanity.com/paper/2002.04025/) (2020)
- [NodeFormer: A Scalable Graph Structure Learning Transformer for Node Classification](https://mlsanity.com/paper/2306.08385/) (2023)
- [Representing Long-Range Context for Graph Neural Networks with Global Attention](https://mlsanity.com/paper/2201.08821/) (2022)
- [A Theoretical Comparison of Graph Neural Network Extensions](https://mlsanity.com/paper/2201.12884/) (2022)
- [1-WL Expressiveness Is (Almost) All You Need](https://mlsanity.com/paper/2202.10156/) (2022)
- [Discriminating Power of Centrality Measures](https://mlsanity.com/paper/1305.3146/) (2013)

## Built on by (most cited first, 3 of 3)

- [No Metric to Rule Them All: Toward Principled Evaluations of Graph-Learning Datasets](https://mlsanity.com/paper/2502.02379/) (2025)
- [Unsupervised Optimisation of GNNs for Node Clustering](https://mlsanity.com/paper/2402.07845/) (2024)
- [PATTERN Can Be Solved from Memory: Generator-Aware Baselines for Synthetic Node Classification](https://mlsanity.com/paper/2610.15020/) (2026)

## Abstract (arXiv)

Graph Neural Networks (GNNs) have emerged as a powerful tool for learning from graph-structured data. However, even state-of-the-art architectures have limitations on what structures they can distinguish, imposing theoretical limits on what the networks can achieve on different datasets. In this paper, we provide a new tool called Graphtester for a comprehensive analysis of the theoretical capabilities of GNNs for various datasets, tasks, and scores. We use Graphtester to analyze over 40 different graph datasets, determining upper bounds on the performance of various GNNs based on the number of layers. Further, we show that the tool can also be used for Graph Transformers using positional node encodings, thereby expanding its scope. Finally, we demonstrate that features generated by Graphtester can be used for practical applications such as Graph Transformers, and provide a synthetic dataset to benchmark node and edge features, such as positional encodings. The package is freely available at the following URL: https://github.com/meakbiyik/graphtester.