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Graph-structured data commonly arise in many real-world applications, and this extends naturally into the quantum setting, where quantum data with inherent graph structures are frequently generated by typical quantum data sources. However,…

Quantum Physics · Physics 2025-08-27 Yanying Liang , Sile Tang , Zhehao Yi , Haozhen Situ , Zhu-Jun Zheng

Graph Neural Networks (GNNs) are powerful and flexible neural networks that use the naturally sparse connectivity information of the data. GNNs represent this connectivity as sparse matrices, which have lower arithmetic intensity and thus…

Machine Learning · Computer Science 2020-09-04 Alok Tripathy , Katherine Yelick , Aydin Buluc

Dynamic link prediction is important for modeling evolving interactions in complex systems, including social, communication, financial, and transportation networks. Classical temporal graph models capture sequential dependencies, but they…

Hybrid Quantum Neural Networks (HQNNs) combine classical learning with parameterized quantum circuits, but their practical performance is often limited by (i) the noise of Noisy Intermediate-Scale Quantum (NISQ) devices and (ii) the large,…

Quantum Physics · Physics 2026-04-17 Tasnim Ahmed , Alberto Marchisio , Muhammad Kashif , Nouhaila Innan , Muhammad Shafique

While kernel methods and Graph Neural Networks offer complementary strengths, integrating the two has posed challenges in efficiency and scalability. The Graph Neural Tangent Kernel provides a theoretical bridge by interpreting GNNs through…

Machine Learning · Computer Science 2025-07-17 Lin Wang , Shijie Wang , Sirui Huang , Qing Li

In representation learning on graph-structured data, many popular graph neural networks (GNNs) fail to capture long-range dependencies, leading to performance degradation. Furthermore, this weakness is magnified when the concerned graph is…

Machine Learning · Computer Science 2024-03-07 Mengying Jiang , Guizhong Liu , Yuanchao Su , Xinliang Wu

Quantum algorithms offer an exponential speedup over classical algorithms for a range of computational problems. The fundamental mechanisms underlying quantum computation required the development and construction of quantum computers. These…

Emerging Technologies · Computer Science 2025-06-12 Shane Sweeney , Krishnendu Guha

Graph Neural Networks (GNNs) have emerged as powerful tools for learning from graph-structured data, leveraging message passing to diffuse information and update node representations. However, most efforts have suggested that native…

Machine Learning · Computer Science 2025-09-23 Sujia Huang , Lele Fu , Zhen Cui , Tong Zhang , Na Song , Bo Huang

Graph neural networks are increasingly becoming the framework of choice for graph-based machine learning. In this paper, we propose a new graph neural network architecture that substitutes classical message passing with an analysis of the…

Machine Learning · Computer Science 2024-01-18 Alessandro Bicciato , Luca Cosmo , Giorgia Minello , Luca Rossi , Andrea Torsello

Circuit representation learning is a promising research direction in the electronic design automation (EDA) field. With sufficient data for pre-training, the learned general yet effective representation can help to solve multiple downstream…

Machine Learning · Computer Science 2023-11-14 Sadaf Khan , Zhengyuan Shi , Min Li , Qiang Xu

Graph Transformer (GT), as a special type of Graph Neural Networks (GNNs), utilizes multi-head attention to facilitate high-order message passing. However, this also imposes several limitations in node classification applications: 1) nodes…

Machine Learning · Computer Science 2024-10-16 Jiajun Zhou , Xuanze Chen , Chenxuan Xie , Yu Shanqing , Qi Xuan , Xiaoniu Yang

Most Graph Neural Networks (GNNs) propagate messages by treating node embeddings as holistic feature vectors, implicitly assuming uniform relevance across feature dimensions. This limits their ability to selectively transmit informative…

Machine Learning · Computer Science 2025-12-24 Longlong Li , Mengyang Zhao , Guanghui Wang , Cunquan Qu

Quantum computing promises advantages over classical computing. The manufacturing of quantum hardware is in the infancy stage, called the Noisy Intermediate-Scale Quantum (NISQ) era. A major challenge is automated quantum circuit design…

Quantum Computing promises to solve complex combinatorial optimization problems more efficiently than classical methods, with the Quantum Approximate Optimization Algorithm (QAOA) being a leading candidate. Recent fixed-parameter variations…

Quantum Physics · Physics 2026-03-04 Rodrigo Coelho , Georg Kruse , Jeanette Miriam Lorenz

Quantum circuit design is a key bottleneck for practical quantum machine learning on complex, real-world data. We present an automated framework that discovers and refines variational quantum circuits (VQCs) using graph-based Bayesian…

Quantum Physics · Physics 2025-12-11 Prashant Kumar Choudhary , Nouhaila Innan , Muhammad Shafique , Rajeev Singh

Various Graph Neural Networks (GNNs) have been successful in analyzing data in non-Euclidean spaces, however, they have limitations such as oversmoothing, i.e., information becomes excessively averaged as the number of hidden layers…

Machine Learning · Computer Science 2024-01-23 Jaeyoon Sim , Sooyeon Jeon , InJun Choi , Guorong Wu , Won Hwa Kim

Session-based recommendation systems suggest relevant items to users by modeling user behavior and preferences using short-term anonymous sessions. Existing methods leverage Graph Neural Networks (GNNs) that propagate and aggregate…

Information Retrieval · Computer Science 2022-01-10 Sai Mitheran , Abhinav Java , Surya Kant Sahu , Arshad Shaikh

This study introduces a novel Graph Neural Network (GNN) architecture that leverages infrared and collinear (IRC) safety and equivariance to enhance the analysis of collider data for Beyond the Standard Model (BSM) discoveries. By…

High Energy Physics - Phenomenology · Physics 2024-08-21 Akanksha Bhardwaj , Christoph Englert , Wrishik Naskar , Vishal S. Ngairangbam , Michael Spannowsky

Graph Neural Networks (GNNs) have proved to be an effective representation learning framework for graph-structured data, and have achieved state-of-the-art performance on many practical predictive tasks, such as node classification, link…

Machine Learning · Computer Science 2021-04-13 Yang Ye , Shihao Ji

Quantum computing is a new computational paradigm that promises applications in several fields, including machine learning. In the last decade, deep learning, and in particular Convolutional neural networks (CNN), have become essential for…

Quantum Physics · Physics 2021-06-14 Iordanis Kerenidis , Jonas Landman , Anupam Prakash
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