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Graph Neural Networks have shown excellent performance on semi-supervised classification tasks. However, they assume access to a graph that may not be often available in practice. In the absence of any graph, constructing k-Nearest Neighbor…

机器学习 · 计算机科学 2021-02-23 Vijay Lingam , Arun Iyer , Rahul Ragesh

Graph convolutional networks (GCN) are viewed as one of the most popular representations among the variants of graph neural networks over graph data and have shown powerful performance in empirical experiments. That $\ell_2$-based graph…

机器学习 · 计算机科学 2023-06-21 Shiyu Liu , Linsen Wei , Shaogao Lv , Ming Li

Graph neural networks (GNNs) have demonstrated remarkable capabilities in learning from graph-structured data, often outperforming traditional Multilayer Perceptrons (MLPs) in numerous graph-based tasks. Although existing works have…

机器学习 · 计算机科学 2025-06-09 Wei Huang , Yuan Cao , Haonan Wang , Xin Cao , Taiji Suzuki

Graph Neural Networks (GNNs) have demonstrated remarkable success in various applications, yet they often struggle to capture long-range dependencies (LRD) effectively. This paper introduces GraphMinNet, a novel GNN architecture that…

机器学习 · 计算机科学 2025-02-04 Md Atik Ahamed , Andrew Cheng , Qiang Ye , Qiang Cheng

The generalization performance of deep neural networks (DNNs) is a critical factor in achieving robust model behavior on unseen data. Recent studies have highlighted the importance of sharpness-based measures in promoting generalization by…

机器学习 · 计算机科学 2025-01-28 Mohamed Hassan , Aleksandar Vakanski , Boyu Zhang , Min Xian

Graph Neural Networks (GNNs) have emerged as the leading paradigm for solving graph analytical problems in various real-world applications. Nevertheless, GNNs could potentially render biased predictions towards certain demographic…

机器学习 · 计算机科学 2022-11-29 Yushun Dong , Song Wang , Jing Ma , Ninghao Liu , Jundong Li

Enhancing the stability of machine learning algorithms under distributional shifts is at the heart of the Out-of-Distribution (OOD) Generalization problem. Derived from causal learning, recent works of invariant learning pursue strict…

机器学习 · 计算机科学 2024-02-15 Jiashuo Liu , Jiayun Wu , Jie Peng , Xiaoyu Wu , Yang Zheng , Bo Li , Peng Cui

Flat regions of the neural network loss landscape have long been hypothesized to correlate with better generalization properties. A closely related but distinct problem is training models that are robust to internal perturbations to their…

机器学习 · 计算机科学 2026-02-10 Philip Jacobson , Ben Feinberg , Suhas Kumar , Sapan Agarwal , T. Patrick Xiao , Christopher Bennett

The simplicity of gradient descent (GD) made it the default method for training ever-deeper and complex neural networks. Both loss functions and architectures are often explicitly tuned to be amenable to this basic local optimization. In…

机器学习 · 计算机科学 2019-04-30 Dmitrii Marin , Meng Tang , Ismail Ben Ayed , Yuri Boykov

Graph neural networks (GNNs) have become compelling models designed to perform learning and inference on graph-structured data. However, little work has been done to understand the fundamental limitations of GNNs for scaling to larger…

机器学习 · 计算机科学 2023-10-27 Hyungeun Lee , Kijung Yoon

Sharpness-Aware Minimization (SAM) has substantially improved the generalization of neural networks under various settings. Despite the success, its effectiveness remains poorly understood. In this work, we discover an intriguing phenomenon…

机器学习 · 计算机科学 2025-02-21 Zhanpeng Zhou , Mingze Wang , Yuchen Mao , Bingrui Li , Junchi Yan

Graph Neural Networks (GNNs) excel in various graph learning tasks but face computational challenges when applied to large-scale graphs. A promising solution is to remove non-essential edges to reduce the computational overheads in GNN.…

机器学习 · 计算机科学 2024-02-05 Guibin Zhang , Yanwei Yue , Kun Wang , Junfeng Fang , Yongduo Sui , Kai Wang , Yuxuan Liang , Dawei Cheng , Shirui Pan , Tianlong Chen

Sharpness-aware minimization (SAM) was proposed to reduce sharpness of minima and has been shown to enhance generalization performance in various settings. In this work we show that perturbing only the affine normalization parameters…

机器学习 · 计算机科学 2023-11-20 Maximilian Mueller , Tiffany Vlaar , David Rolnick , Matthias Hein

Graph Neural Networks (GNNs) are widely deployed in vast fields, but they often struggle to maintain accurate representations as graphs evolve. We theoretically establish a lower bound, proving that under mild conditions, representation…

机器学习 · 计算机科学 2024-04-09 Bin Lu , Tingyan Ma , Xiaoying Gan , Xinbing Wang , Yunqiang Zhu , Chenghu Zhou , Shiyu Liang

Graph neural networks (GNNs) work remarkably well in semi-supervised node regression, yet a rigorous theory explaining when and why they succeed remains lacking. To address this gap, we study an aggregate-and-readout model that encompasses…

机器学习 · 统计学 2026-02-20 Juntong Chen , Claire Donnat , Olga Klopp , Johannes Schmidt-Hieber

Graph Neural Networks (GNNs) have attracted increasing attention in recent years and have achieved excellent performance in semi-supervised node classification tasks. The success of most GNNs relies on one fundamental assumption, i.e., the…

机器学习 · 计算机科学 2024-12-03 Junchao Lin , Yuan Wan , Jingwen Xu , Xingchen Qi

Fault location in distribution grids is critical for reliability and minimizing outage durations. Yet, it remains challenging due to partial observability, given sparse measurement infrastructure. Recent works show promising results by…

机器学习 · 计算机科学 2026-05-11 Burak Karabulut , Carlo Manna , Chris Develder

We consider the problem of learning a graph from a finite set of noisy graph signal observations, the goal of which is to find a smooth representation of the graph signal. Such a problem is motivated by the desire to infer relational…

机器学习 · 计算机科学 2023-02-08 Xiaolu Wang , Yuen-Man Pun , Anthony Man-Cho So

We investigate the vulnerability of Graph Neural Networks (GNNs) to bit-flip attacks (BFAs) by introducing an analytical framework to study the influence of architectural features, graph properties, and their interaction. The expressivity…

机器学习 · 计算机科学 2025-04-21 Lorenz Kummer , Wilfried N. Gansterer , Nils M. Kriege

Despite the recent success of graph neural networks (GNN), common architectures often exhibit significant limitations, including sensitivity to oversmoothing, long-range dependencies, and spurious edges, e.g., as can occur as a result of…

机器学习 · 计算机科学 2021-12-06 Yongyi Yang , Tang Liu , Yangkun Wang , Jinjing Zhou , Quan Gan , Zhewei Wei , Zheng Zhang , Zengfeng Huang , David Wipf