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We explore the feasibility of combining Graph Neural Network-based policy architectures with Deep Reinforcement Learning as an approach to problems in systems. This fits particularly well with operations on networks, which naturally take…

Machine Learning · Computer Science 2021-12-02 Oliver Hope , Eiko Yoneki

The quest for efficient and robust deep learning models for molecular systems representation is increasingly critical in scientific exploration. The advent of message passing neural networks has marked a transformative era in graph-based…

Computational Physics · Physics 2026-01-05 Jian Chang , Shuze Zhu

Graph neural network (GNN), the mainstream method to learn on graph data, is vulnerable to graph evasion attacks, where an attacker slightly perturbing the graph structure can fool trained GNN models. Existing work has at least one of the…

Cryptography and Security · Computer Science 2023-12-19 Binghui Wang , Tianxiang Zhou , Minhua Lin , Pan Zhou , Ang Li , Meng Pang , Hai Li , Yiran Chen

Security assessment is one of the most crucial functions of a power system operator. However, growing complexity and unpredictability make this an increasingly complex and computationally difficult task. In recent times, machine learning…

Systems and Control · Electrical Eng. & Systems 2024-06-06 Glory Justin , Santiago Paternain

Including covariant information, such as position, force, velocity or spin is important in many tasks in computational physics and chemistry. We introduce Steerable E(3) Equivariant Graph Neural Networks (SEGNNs) that generalise equivariant…

Machine Learning · Computer Science 2022-03-29 Johannes Brandstetter , Rob Hesselink , Elise van der Pol , Erik J Bekkers , Max Welling

The growing complexity of wireless systems has accelerated the move from traditional methods to learning-based solutions. Graph Neural Networks (GNNs) are especially well-suited here, since wireless networks can be naturally represented as…

Signal Processing · Electrical Eng. & Systems 2025-10-02 Romina Garcia Camargo , Zhiyang Wang , Alejandro Ribeiro

Graph coarsening aims to reduce the size of a large graph while preserving some of its key properties, which has been used in many applications to reduce computational load and memory footprint. For instance, in graph machine learning,…

Machine Learning · Computer Science 2024-05-29 Antonin Joly , Nicolas Keriven

Graph neural networks based on iterative one-hop message passing have been shown to struggle in harnessing the information from distant nodes effectively. Conversely, graph transformers allow each node to attend to all other nodes directly,…

Machine Learning · Computer Science 2024-06-06 Yuhui Ding , Antonio Orvieto , Bobby He , Thomas Hofmann

Graph neural networks (GNNs) and message passing neural networks (MPNNs) have been proven to be expressive for subgraph structures in many applications. Some applications in heterogeneous graphs require explicit edge modeling, such as…

Machine Learning · Computer Science 2021-12-17 Xin Liu , Yangqiu Song

Graph limit models, like graphons for limits of dense graphs, have recently been used to study size transferability of graph neural networks (GNNs). While most literature focuses on message passing GNNs (MPNNs), in this work we attend to…

Machine Learning · Computer Science 2025-05-20 Daniel Herbst , Stefanie Jegelka

Graph neural networks (GNNs) emerge as a powerful approach to process non-euclidean data structures and have been proved powerful in various application domains such as social networks and e-commerce. While such graph data maintained in…

Distributed, Parallel, and Cluster Computing · Computer Science 2023-04-06 Shengwen Liang , Ying Wang , Cheng Liu , Lei He , Huawei Li , Xiaowei Li

Deep neural networks (NNs) are considered a powerful tool for balancing the performance and complexity of multiple-input multiple-output (MIMO) receivers due to their accurate feature extraction, high parallelism, and excellent inference…

Information Theory · Computer Science 2024-10-28 Xingyu Zhou , Jing Zhang , Chao-Kai Wen , Shi Jin , Shuangfeng Han

Hypergraph, an expressive structure with flexibility to model the higher-order correlations among entities, has recently attracted increasing attention from various research domains. Despite the success of Graph Neural Networks (GNNs) for…

Machine Learning · Computer Science 2021-05-04 Jing Huang , Jie Yang

Graph neural networks (GNNs) have recently exploded in popularity thanks to their broad applicability to graph-related problems such as quantum chemistry, drug discovery, and high energy physics. However, meeting demand for novel GNN models…

Distributed, Parallel, and Cluster Computing · Computer Science 2022-10-20 Rishov Sarkar , Stefan Abi-Karam , Yuqi He , Lakshmi Sathidevi , Cong Hao

A network intrusion usually involves a number of network locations. Data flow (including the data generated by intrusion behaviors) among these locations (usually represented by IP addresses) naturally forms a graph. Thus, graph neural…

Cryptography and Security · Computer Science 2023-10-27 Xiang Li , Jing Zhang , Yali Yuan , Cangqi Zhou

Graph Convolutional Networks (GCN) have been effective at tasks that have rich relational structure and can preserve global structure information of a dataset in graph embeddings. Recently, many researchers focused on examining whether GCNs…

Computation and Language · Computer Science 2022-03-31 Soyeon Caren Han , Zihan Yuan , Kunze Wang , Siqu Long , Josiah Poon

The most prevalent class of neural networks operating on graphs are message passing neural networks (MPNNs), in which the representation of a node is updated iteratively by aggregating information in the 1-hop neighborhood. Since this…

Machine Learning · Computer Science 2023-10-25 Floor Eijkelboom , Erik Bekkers , Michael Bronstein , Francesco Di Giovanni

We introduce a graph neural network architecture designed to extract novel phenomena in the Standard Model Effective Field Theory (SMEFT) context from LHC collision data. The proposed infrared- and collinear-safe architecture is sensitive…

High Energy Physics - Phenomenology · Physics 2024-05-16 Suman Chatterjee , Sergio Sánchez Cruz , Robert Schöfbeck , Dennis Schwarz

Deep neural networks have recently emerged as a disruptive technology to solve NP-hard wireless resource allocation problems in a real-time manner. However, the adopted neural network structures, e.g., multi-layer perceptron (MLP) and…

Information Theory · Computer Science 2019-07-22 Yifei Shen , Yuanming Shi , Jun Zhang , Khaled B. Letaief

Heterogeneous Graph Neural Networks (HGNNs) are powerful tools for deep learning on heterogeneous graphs. Typical HGNNs require repetitive message passing during training, limiting efficiency for large-scale real-world graphs. Recent…

Machine Learning · Computer Science 2024-09-04 Jun Hu , Bryan Hooi , Bingsheng He
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