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Combinatorial optimization (CO) problems arise across a broad spectrum of domains, including medicine, logistics, and manufacturing. While exact solutions are often computationally infeasible, many practical applications require…

Machine Learning · Computer Science 2025-05-27 Arman Mielke , Uwe Bauknecht , Thilo Strauss , Mathias Niepert

Graph neural networks (GNNs) have achieved great success for a variety of tasks such as node classification, graph classification, and link prediction. However, the use of GNNs (and machine learning more generally) to solve combinatorial…

Machine Learning · Computer Science 2024-11-26 Frederik Wenkel , Semih Cantürk , Stefan Horoi , Michael Perlmutter , Guy Wolf

Neural Combinatorial Optimization (NCO) has emerged as a promising learning-based paradigm for addressing Vehicle Routing Problems (VRPs) by minimizing the need for extensive manual engineering. While existing NCO methods, trained on…

Machine Learning · Computer Science 2025-11-24 Yuanyao Chen , Rongsheng Chen , Fu Luo , Zhenkun Wang

Since the 1990s, considerable empirical work has been carried out to train statistical models, such as neural networks (NNs), as learned heuristics for combinatorial optimization (CO) problems. When successful, such an approach eliminates…

Machine Learning · Statistics 2026-01-21 Orit Davidovich , Shimrit Shtern , Segev Wasserkrug , Nimrod Megiddo

Many real-world problems can be reduced to combinatorial optimization on a graph, where the subset or ordering of vertices that maximize some objective function must be found. With such tasks often NP-hard and analytically intractable,…

Machine Learning · Computer Science 2021-03-22 Thomas D. Barrett , William R. Clements , Jakob N. Foerster , A. I. Lvovsky

Solving combinatorial optimization (CO) on graphs is among the fundamental tasks for upper-stream applications in data mining, machine learning and operations research. Despite the inherent NP-hard challenge for CO, heuristics,…

Optimization and Control · Mathematics 2022-06-07 Han Lu , Zenan Li , Runzhong Wang , Qibing Ren , Junchi Yan , Xiaokang Yang

We investigate a link between Graph Neural Networks (GNNs) and Quadratic Unconstrained Binary Optimization (QUBO) problems, laying the groundwork for GNNs to approximate solutions for these computationally challenging tasks. By analyzing…

Machine Learning · Computer Science 2025-08-26 Moshe Eliasof , Eldad Haber

The design of good heuristics or approximation algorithms for NP-hard combinatorial optimization problems often requires significant specialized knowledge and trial-and-error. Can we automate this challenging, tedious process, and learn the…

Machine Learning · Computer Science 2018-02-23 Hanjun Dai , Elias B. Khalil , Yuyu Zhang , Bistra Dilkina , Le Song

Combinatorial optimization problems (COPs) on the graph with real-life applications are canonical challenges in Computer Science. The difficulty of finding quality labels for problem instances holds back leveraging supervised learning…

Machine Learning · Computer Science 2021-08-10 Mostafa Pashazadeh , Kui Wu

The success of machine learning solutions for reasoning about discrete structures has brought attention to its adoption within combinatorial optimization algorithms. Such approaches generally rely on supervised learning by leveraging…

Machine Learning · Computer Science 2022-03-17 Ismail R. Alkhouri , George K. Atia , Alvaro Velasquez

Physics-inspired graph neural networks (PI-GNNs) have been utilized as an efficient unsupervised framework for relaxing combinatorial optimization problems encoded through a specific graph structure and loss, reflecting dependencies between…

Machine Learning · Computer Science 2025-10-24 Martin Krutský , Gustav Šír , Vyacheslav Kungurtsev , Georgios Korpas

Traditional maximum entropy and sparsity-based algorithms for analytic continuation often suffer from the ill-posed kernel matrix or demand tremendous computation time for parameter tuning. Here we propose a neural network method by convex…

Machine Learning · Computer Science 2022-02-07 Dongchen Huang , Yi-feng Yang

Unsupervised learning (UL)-based solvers for combinatorial optimization (CO) train a neural network that generates a soft solution by directly optimizing the CO objective using a continuous relaxation strategy. These solvers offer several…

Machine Learning · Statistics 2024-11-01 Yuma Ichikawa

Neural combinatorial optimization (NCO) aims at designing problem-independent and efficient neural network-based strategies for solving combinatorial problems. The field recently experienced growth by successfully adapting architectures…

Machine Learning · Computer Science 2020-11-13 Michal Lisicki , Arash Afkanpour , Graham W. Taylor

Neural combinatorial optimization (NCO) solvers, implemented with graph neural networks (GNNs), have introduced new approaches for solving routing problems. Trained with reinforcement learning (RL), the state-of-the-art graph attention…

Machine Learning · Computer Science 2026-01-30 Licheng Wang , Yuzi Yan , Mingtao Huang , Yuan Shen

Graph Neural Networks (GNNs) have emerged as a powerful and flexible framework for representation learning on irregular data. As they generalize the operations of classical CNNs on grids to arbitrary topologies, GNNs also bring much of the…

Machine Learning · Computer Science 2021-03-31 Mehdi Bahri , Gaétan Bahl , Stefanos Zafeiriou

Despite the recent advances of graph neural networks (GNNs) in modeling graph data, the training of GNNs on large datasets is notoriously hard due to the overfitting. Adversarial training, which augments data with the worst-case adversarial…

Machine Learning · Computer Science 2021-10-29 Haotian Xue , Kaixiong Zhou , Tianlong Chen , Kai Guo , Xia Hu , Yi Chang , Xin Wang

Diagnosing the minimal set of faults capable of explaining a set of given observations, e.g., from sensor readouts, is a hard combinatorial optimization problem usually tackled with artificial intelligence techniques. We present the mapping…

Although graph neural networks (GNNs) have achieved impressive achievements in graph classification, they often need abundant task-specific labels, which could be extensively costly to acquire. A credible solution is to explore additional…

Machine Learning · Computer Science 2025-07-15 Nan Yin , Li Shen , Mengzhu Wang , Long Lan , Zeyu Ma , Chong Chen , Xian-Sheng Hua , Xiao Luo

Combinatorial optimization problems are ubiquitous in science and engineering. Still, learning-based approaches to accelerate combinatorial optimization often require solving a large number of difficult instances to collect training data,…

Machine Learning · Computer Science 2025-09-25 Zohair Shafi , Serdar Kadioglu