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We propose a quantum algorithm for calculating the structural properties of complex networks and graphs. The corresponding protocol -- deteQt -- is designed to perform large-scale community and botnet detection, where a specific subgraph of…

Quantum Physics · Physics 2025-11-18 Chukwudubem Umeano , Stefano Scali , Oleksandr Kyriienko

In this research, we developed a graph-based framework to represent various aspects of optimal thermal management system design, with the aim of rapidly and efficiently identifying optimal design candidates. Initially, the graph-based…

Systems and Control · Electrical Eng. & Systems 2023-11-28 Saeid Bayat , Nastaran Shahmansouri , Satya RT Peddada , Alex Tessier , Adrian Butscher , James T Allison

Recent progress in Graph Neural Networks (GNNs) for modeling atomic simulations has the potential to revolutionize catalyst discovery, which is a key step in making progress towards the energy breakthroughs needed to combat climate change.…

Machine Learning · Computer Science 2022-04-12 Anuroop Sriram , Abhishek Das , Brandon M. Wood , Siddharth Goyal , C. Lawrence Zitnick

A computational graph in a deep neural network (DNN) denotes a specific data flow diagram (DFD) composed of many tensors and operators. Existing toolkits for visualizing computational graphs are not applicable when the structure is highly…

Human-Computer Interaction · Computer Science 2023-01-02 Rusheng Pan , Zhiyong Wang , Yating Wei , Han Gao , Gongchang Ou , Caleb Chen Cao , Jingli Xu , Tong Xu , Wei Chen

In recent years, machine learning has been adopted to complex networks, but most existing works concern about the structural properties. To use machine learning to detect phase transitions and accurately identify the critical transition…

Physics and Society · Physics 2020-01-08 Qi Ni , Ming Tang , Ying Liu , Ying-Cheng Lai

The escalating frequency of cyber-attacks poses significant challenges for organisations, particularly small enterprises constrained by limited in-house expertise, insufficient knowledge, and financial resources. This research presents a…

Cryptography and Security · Computer Science 2026-03-16 Emad Sherif , Iryna Yevseyeva , Vitor Basto-Fernandes , Allan Cook

Digital systems find it challenging to keep up with cybersecurity threats. The daily emergence of more than 560,000 new malware strains poses significant hazards to the digital ecosystem. The traditional malware detection methods fail to…

Cryptography and Security · Computer Science 2025-04-28 Abrar Fahim , Shamik Dey , Md. Nurul Absur , Md Kamrul Siam , Md. Tahmidul Huque , Jafreen Jafor Godhuli

Temporal Graph Learning (TGL) has become a robust framework for discovering patterns in dynamic networks and predicting future interactions. While existing research has largely concentrated on learning from individual networks, this study…

This study proposes a credit card fraud detection method based on Heterogeneous Graph Neural Network (HGNN) to address fraud in complex transaction networks. Unlike traditional machine learning methods that rely solely on numerical features…

Machine Learning · Computer Science 2025-04-14 Qiuwu Sha , Tengda Tang , Xinyu Du , Jie Liu , Yixian Wang , Yuan Sheng

Graph Neural Networks (GNNs) have shown success in various fields for learning from graph-structured data. This paper investigates the application of ensemble learning techniques to improve the performance and robustness of Graph Neural…

Machine Learning · Computer Science 2023-10-24 Zhen Hao Wong , Ling Yue , Quanming Yao

Graph neural networks (GNNs) have been increasingly deployed in various applications that involve learning on non-Euclidean data. However, recent studies show that GNNs are vulnerable to graph adversarial attacks. Although there are several…

Machine Learning · Computer Science 2023-01-10 Chenhui Deng , Xiuyu Li , Zhuo Feng , Zhiru Zhang

An increasing number of machine learning tasks require dealing with large graph datasets, which capture rich and complex relationship among potentially billions of elements. Graph Neural Network (GNN) becomes an effective way to address the…

Distributed, Parallel, and Cluster Computing · Computer Science 2019-02-26 Rong Zhu , Kun Zhao , Hongxia Yang , Wei Lin , Chang Zhou , Baole Ai , Yong Li , Jingren Zhou

Protecting against multi-step attacks of uncertain duration and timing forces defenders into an indefinite, always ongoing, resource-intensive response. To effectively allocate resources, a defender must be able to analyze multi-step…

Cryptography and Security · Computer Science 2021-07-12 Alexander V. Outkin , Patricia V. Schulz , Timothy Schulz , Thomas D. Tarman , Ali Pinar

Graph-based classification methods are widely used for security and privacy analytics. Roughly speaking, graph-based classification methods include collective classification and graph neural network. Evading a graph-based classification…

Cryptography and Security · Computer Science 2019-08-14 Binghui Wang , Neil Zhenqiang Gong

Accurate phase equilibria are foundational to alloy design because they encode the underlying thermodynamics governing stability, transformations, and processing windows. However, while the CALculation of Phase Diagrams (CALPHAD) provides a…

Machine Learning · Computer Science 2026-04-21 Eunjeong Park , Amrita Basak

Graph networks are a new machine learning (ML) paradigm that supports both relational reasoning and combinatorial generalization. Here, we develop universal MatErials Graph Network (MEGNet) models for accurate property prediction in both…

Materials Science · Physics 2019-04-29 Chi Chen , Weike Ye , Yunxing Zuo , Chen Zheng , Shyue Ping Ong

As the complexity of modern systems increases, so does the importance of assessing their security posture through effective vulnerability management and threat modeling techniques. One powerful tool in the arsenal of cybersecurity…

Cryptography and Security · Computer Science 2024-08-13 Renascence Tarafder Prapty , Ashish Kundu , Arun Iyengar

Law-enforcement investigations aimed at preventing attacks by violent extremists have become increasingly important for public safety. The problem is exacerbated by the massive data volumes that need to be scanned to identify complex…

Social and Information Networks · Computer Science 2023-10-31 Shashika R. Muramudalige , Benjamin W. K. Hung , Rosanne Libretti , Jytte Klausen , Anura P. Jayasumana

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

Epidemic outcomes have a complex interplay with human behavior and beliefs. Most of the forecasting literature has focused on the task of predicting epidemic signals using simple mechanistic models or black-box models, such as deep…

Machine Learning · Computer Science 2025-12-02 Mulin Tian , Ajitesh Srivastava
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