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The graph neural network (GNN) has demonstrated its superior performance in various applications. The working mechanism behind it, however, remains mysterious. GNN models are designed to learn effective representations for graph-structured…

机器学习 · 计算机科学 2022-06-10 Zepeng Zhang , Ziping Zhao

Similarity search is a fundamental task for exploiting information in various applications dealing with graph data, such as citation networks or knowledge graphs. While this task has been intensively approached from heuristics to graph…

机器学习 · 计算机科学 2026-05-12 Daniel Daza , Cuong Xuan Chu , Trung-Kien Tran , Daria Stepanova , Michael Cochez , Paul Groth

Online bipartite matching with edge arrivals remained a major open question for a long time until a recent negative result by [Gamlath et al. FOCS 2019], who showed that no online policy is better than the straightforward greedy algorithm,…

数据结构与算法 · 计算机科学 2020-07-17 Nick Gravin , Zhihao Gavin Tang , Kangning Wang

Graph Neural Network (GNN) is a powerful model to learn representations and make predictions on graph data. Existing efforts on GNN have largely defined the graph convolution as a weighted sum of the features of the connected nodes to form…

机器学习 · 计算机科学 2020-06-02 Hongmin Zhu , Fuli Feng , Xiangnan He , Xiang Wang , Yan Li , Kai Zheng , Yongdong Zhang

Graph Neural Networks (GNNs) have been highly successful for the node classification task. GNNs typically assume graphs are homophilic, i.e. neighboring nodes are likely to belong to the same class. However, a number of real-world graphs…

机器学习 · 计算机科学 2024-09-20 Yurui Lai , Taiyan Zhang , Rui Fan

Bundle pricing refers to designing several product combinations (i.e., bundles) and determining their prices in order to maximize the expected profit. It is a classic problem in revenue management and arises in many industries, such as…

机器学习 · 计算机科学 2025-10-08 Liangyu Ding , Chenghan Wu , Guokai Li , Zizhuo Wang

Within the context of stochastic probing with commitment, we consider the online stochastic matching problem; that is, the one-sided online bipartite matching problem where edges adjacent to an online node must be probed to determine if…

数据结构与算法 · 计算机科学 2021-03-02 Allan Borodin , Calum MacRury , Akash Rakheja

Group recommendation aims at providing optimized recommendations tailored to diverse groups, enabling groups to enjoy appropriate items. On the other hand, most existing group recommendation methods are built upon deep neural network (DNN)…

信息检索 · 计算机科学 2025-02-14 Chae-Hyun Kim , Yoon-Ryung Choi , Jin-Duk Park , Won-Yong Shin

We study two-stage bipartite matching, in which the edges of a bipartite graph on vertices $(B_1 \cup B_2, I)$ are revealed in two batches. In stage one, a matching must be selected from among revealed edges $E \subseteq B_1 \times I$. In…

数据结构与算法 · 计算机科学 2025-10-24 Tristan Pollner , Amin Saberi , Anders Wikum

Graph neural network (GNN) based methods have saturated the field of recommender systems. The gains of these systems have been significant, showing the advantages of interpreting data through a network structure. However, despite the…

机器学习 · 计算机科学 2022-09-12 Rebecca Salganik , Fernando Diaz , Golnoosh Farnadi

Molecular docking is a major element in drug discovery and design. It enables the prediction of ligand-protein interactions by simulating the binding of small molecules to proteins. Despite the availability of numerous docking algorithms,…

生物大分子 · 定量生物学 2024-11-20 Yiliang Yuan , Mustafa Misir

Graph neural networks (GNN) has been successfully applied to operate on the graph-structured data. Given a specific scenario, rich human expertise and tremendous laborious trials are usually required to identify a suitable GNN architecture.…

机器学习 · 计算机科学 2019-09-11 Kaixiong Zhou , Qingquan Song , Xiao Huang , Xia Hu

Graph Neural Networks (GNNs) have achieved unprecedented success in identifying categorical labels of graphs. However, most existing graph classification problems with GNNs follow the protocol of balanced data splitting, which misaligns…

机器学习 · 计算机科学 2022-09-29 Yu Wang , Yuying Zhao , Neil Shah , Tyler Derr

Graph neural networks (GNNs) are popular to use for classifying structured data in the context of machine learning. But surprisingly, they are rarely applied to regression problems. In this work, we adopt GNN for a classic but challenging…

机器学习 · 计算机科学 2021-02-16 Wenzhong Yan , Di Jin , Zhidi Lin , Feng Yin

The generalized Gauss-Newton (GGN) approximation is often used to make practical Bayesian deep learning approaches scalable by replacing a second order derivative with a product of first order derivatives. In this paper we argue that the…

机器学习 · 统计学 2021-02-26 Alexander Immer , Maciej Korzepa , Matthias Bauer

Graph Neural Networks (GNNs) have attracted considerable attention and have emerged as a new promising paradigm to process graph-structured data. GNNs are usually stacked to multiple layers and the node representations in each layer are…

机器学习 · 计算机科学 2020-09-25 Yihao Chen , Xin Tang , Xianbiao Qi , Chun-Guang Li , Rong Xiao

Graph Neural Networks (GNNs) have emerged as powerful tools for various graph mining tasks, yet existing scalable solutions often struggle to balance execution efficiency with prediction accuracy. These difficulties stem from iterative…

机器学习 · 计算机科学 2026-04-02 Xu Cheng , Liang Yao , Feng He , Yukuo Cen , Yufei He , Chenhui Zhang , Wenzheng Feng , Hongyun Cai , Jie Tang

Graph-based data present unique challenges and opportunities for machine learning. Graph Neural Networks (GNNs), and especially those algorithms that capture graph topology through message passing for neighborhood aggregation, have been a…

机器学习 · 计算机科学 2024-04-19 Zheyi Qin , Randy Paffenroth , Anura P. Jayasumana

Graph neural networks (GNNs) are powerful models that have been successful in various graph representation learning tasks. Whereas gradient boosted decision trees (GBDT) often outperform other machine learning methods when faced with…

机器学习 · 计算机科学 2021-04-01 Sergei Ivanov , Liudmila Prokhorenkova

Machine learning on graph-structured data has attracted high research interest due to the emergence of Graph Neural Networks (GNNs). Most of the proposed GNNs are based on the node homophily, i.e neighboring nodes share similar…

机器学习 · 计算机科学 2021-02-18 George Dasoulas , Giannis Nikolentzos , Kevin Scaman , Aladin Virmaux , Michalis Vazirgiannis