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Related papers: Verifying Quantized GNNs With Readout Is Decidable…

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In this paper, we investigate the verification of quantized Graph Neural Networks (GNNs), where some fixed-width arithmetic is used to represent numbers. We introduce the linear-constrained validity (LVP) problem for verifying GNNs…

Logic in Computer Science · Computer Science 2025-08-14 Marco Sälzer , François Schwarzentruber , Nicolas Troquard

Graph Neural Networks (GNNs) have emerged as the predominant approach for learning over graph-structured data. However, most GNNs operate as black-box models and require post-hoc explanations, which may not suffice in high-stakes scenarios…

Machine Learning · Computer Science 2025-10-14 Maya Bechler-Speicher , Amir Globerson , Ran Gilad-Bachrach

In recent years, there has been growing interest in understanding the expressive power of graph neural networks (GNNs) by relating them to logical languages. This research has been been initialised by an influential result of Barcel\'o et…

Artificial Intelligence · Computer Science 2025-08-11 Stan P Hauke , Przemysław Andrzej Wałęga

We study the expressive power of message-passing aggregate-combine-readout graph neural networks (ACR-GNNs). Particularly, we focus on the first-order (FO) properties expressible by this formalism. While a tight logical characterisation…

Machine Learning · Computer Science 2026-04-28 Maurice Funk , Daumantas Kojelis

Graph neural networks (GNNs) are the predominant approach for graph-based machine learning. While neural networks have shown great performance at learning useful representations, they are often criticized for their limited high-level…

Machine Learning · Computer Science 2024-07-09 Markus Zopf , Francesco Alesiani

Graph neural networks (GNNs) are powerful graph-based deep-learning models that have gained significant attention and demonstrated remarkable performance in various domains, including natural language processing, drug discovery, and…

Machine Learning · Computer Science 2023-06-06 Jaykumar Kakkad , Jaspal Jannu , Kartik Sharma , Charu Aggarwal , Sourav Medya

Advances in machine learning have led to graph neural network-based methods for drug discovery, yielding promising results in molecular design, chemical synthesis planning, and molecular property prediction. However, current graph neural…

Quantitative Methods · Quantitative Biology 2021-07-13 Jiahua Rao , Shuangjia Zheng , Yuedong Yang

We investigate the computational complexity of neural network verification in quantised settings. We distinguish three classes of Feedforward Neural Networks (FNNs): rational FNNs with exact rational weights, quantised FNNs whose weights…

Computational Complexity · Computer Science 2026-05-29 Eric Alsmann , Martin Lange , Marco Sälzer

Graph Neural Networks (GNNs) are powerful machine learning prediction models on graph-structured data. However, GNNs lack rigorous uncertainty estimates, limiting their reliable deployment in settings where the cost of errors is…

Machine Learning · Computer Science 2023-11-01 Kexin Huang , Ying Jin , Emmanuel Candès , Jure Leskovec

We present results concerning the expressiveness and decidability of a popular graph learning formalism, graph neural networks (GNNs), exploiting connections with logic. We use a family of recently-discovered decidable logics involving…

Logic in Computer Science · Computer Science 2025-01-31 Michael Benedikt , Chia-Hsuan Lu , Tony Tan

Graph neural networks (GNNs) have demonstrated strong performance on a wide variety of tasks due to their ability to model non-uniform structured data. Despite their promise, there exists little research exploring methods to make them more…

Machine Learning · Computer Science 2021-03-16 Shyam A. Tailor , Javier Fernandez-Marques , Nicholas D. Lane

Question Answering (QA) has been a long-standing research topic in AI and NLP fields, and a wealth of studies have been conducted to attempt to equip QA systems with human-level reasoning capability. To approximate the complicated human…

Artificial Intelligence · Computer Science 2021-10-08 Kuan Wang , Yuyu Zhang , Diyi Yang , Le Song , Tao Qin

Output reachability and adversarial robustness are among the most relevant safety properties of neural networks. We show that in the context of Message Passing Neural Networks (MPNN), a common Graph Neural Network (GNN) model, formal…

Machine Learning · Computer Science 2022-10-05 Marco Sälzer , Martin Lange

Quantum Graph Neural Networks (QGNNs) represent a novel fusion of quantum computing and Graph Neural Networks (GNNs), aimed at overcoming the computational and scalability challenges inherent in classical GNNs that are powerful tools for…

Neural networks have emerged as essential components in safety-critical applications -- these use cases demand complex, yet trustworthy computations. Binarized Neural Networks (BNNs) are a type of neural network where each neuron is…

Machine Learning · Computer Science 2025-07-08 Jiong Yang , Yong Kiam Tan , Mate Soos , Magnus O. Myreen , Kuldeep S. Meel

Graph Neural Networks (GNNs) have advanced significantly in handling graph-structured data, but a comprehensive framework for evaluating explainability remains lacking. Existing evaluation frameworks primarily involve post-hoc explanations,…

Machine Learning · Computer Science 2026-05-18 Magdalena Proszewska , N. Siddharth

Graph neural networks (GNNs) have demonstrated a significant boost in prediction performance on graph data. At the same time, the predictions made by these models are often hard to interpret. In that regard, many efforts have been made to…

Machine Learning · Computer Science 2023-05-24 Yiqiao Li , Jianlong Zhou , Sunny Verma , Fang Chen

Quantization replaces floating point arithmetic with integer arithmetic in deep neural network models, providing more efficient on-device inference with less power and memory. In this work, we propose a framework for formally verifying…

Machine Learning · Computer Science 2023-12-29 Pei Huang , Haoze Wu , Yuting Yang , Ieva Daukantas , Min Wu , Yedi Zhang , Clark Barrett

We investigate the computational complexity of various problems for simple recurrent neural networks (RNNs) as formal models for recognizing weighted languages. We focus on the single-layer, ReLU-activation, rational-weight RNNs with…

Formal Languages and Automata Theory · Computer Science 2018-03-06 Yining Chen , Sorcha Gilroy , Andreas Maletti , Jonathan May , Kevin Knight

Graph neural networks (GNNs) are effective machine learning models for various graph learning problems. Despite their empirical successes, the theoretical limitations of GNNs have been revealed recently. Consequently, many GNN models have…

Machine Learning · Computer Science 2020-10-19 Ryoma Sato
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