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Out-of-distribution (OOD) generalization has emerged as a critical challenge in graph learning, as real-world graph data often exhibit diverse and shifting environments that traditional models fail to generalize across. A promising solution…

Machine Learning · Computer Science 2025-08-05 Xu Shen , Yixin Liu , Yili Wang , Rui Miao , Yiwei Dai , Shirui Pan , Yi Chang , Xin Wang

Graph Transformers (GTs) have demonstrated great effectiveness across various graph analytical tasks. However, the existing GTs focus on training and testing graph data originated from the same distribution, but fail to generalize under…

Machine Learning · Computer Science 2026-03-16 Tianyin Liao , Ziwei Zhang , Yufei Sun , Chunyu Hu , Jianxin Li

Despite recent success in using the invariance principle for out-of-distribution (OOD) generalization on Euclidean data (e.g., images), studies on graph data are still limited. Different from images, the complex nature of graphs poses…

Machine Learning · Computer Science 2022-10-12 Yongqiang Chen , Yonggang Zhang , Yatao Bian , Han Yang , Kaili Ma , Binghui Xie , Tongliang Liu , Bo Han , James Cheng

Operator learning seeks to approximate mappings from input functions to output solutions, particularly in the context of partial differential equations (PDEs). While recent advances such as DeepONet and Fourier Neural Operator (FNO) have…

Machine Learning · Computer Science 2025-05-27 Yile Li , Shandian Zhe

Invariant learning demonstrates substantial potential for enhancing the generalization of graph neural networks (GNNs) with out-of-distribution (OOD) data. It aims to recognize stable features in graph data for classification, based on the…

Machine Learning · Computer Science 2025-01-23 Yongduo Sui , Jie Sun , Shuyao Wang , Zemin Liu , Qing Cui , Longfei Li , Xiang Wang

Graph-based social recommendation systems have shown significant promise in enhancing recommendation performance, particularly in addressing the issue of data sparsity in user behaviors. Typically, these systems leverage Graph Neural…

Information Retrieval · Computer Science 2025-04-29 Yonghui Yang , Le Wu , Yuxin Liao , Zhuangzhuang He , Pengyang Shao , Richang Hong , Meng Wang

Recent work has extended the invariance principle for out-of-distribution (OOD) generalization from Euclidean to graph data, where challenges arise due to complex structures and diverse distribution shifts in node attributes and topology.…

Machine Learning · Computer Science 2025-12-01 Ali Ghasemi , Farooq Ahmad Wani , Maria Sofia Bucarelli , Fabrizio Silvestri

Out-of-distribution (OOD) generalization is an important issue for Graph Neural Networks (GNNs). Recent works employ different graph editions to generate augmented environments and learn an invariant GNN for generalization. However, the…

Machine Learning · Computer Science 2023-03-28 Junchi Yu , Jian Liang , Ran He

Graph out-of-distribution (OOD) generalization remains a major challenge in graph learning since graph neural networks (GNNs) often suffer from severe performance degradation under distribution shifts. Invariant learning, aiming to extract…

Machine Learning · Computer Science 2025-02-14 Wenyu Mao , Jiancan Wu , Haoyang Liu , Yongduo Sui , Xiang Wang

Although dynamic graph neural networks (DyGNNs) have demonstrated promising capabilities, most existing methods ignore out-of-distribution (OOD) shifts that commonly exist in dynamic graphs. Dynamic graph OOD generalization is non-trivial…

Machine Learning · Computer Science 2026-03-03 Xinxun Zhang , Pengfei Jiao , Mengzhou Gao , Tianpeng Li , Xuan Guo

We present an approach to modifying Transformer architectures by integrating graph-aware relational reasoning into the attention mechanism, merging concepts from graph neural networks and language modeling. Building on the inherent…

Machine Learning · Computer Science 2025-03-06 Markus J. Buehler

Intrinsic interpretability of graph neural networks (GNNs) is to find a small subset of the input graph's features -- rationale -- which guides the model prediction. Unfortunately, the leading rationalization models often rely on data…

Machine Learning · Computer Science 2022-02-01 Ying-Xin Wu , Xiang Wang , An Zhang , Xiangnan He , Tat-Seng Chua

Learning robust models under distribution shifts between training and test datasets is a fundamental challenge in machine learning. While learning invariant features across environments is a popular approach, it often assumes that these…

Machine Learning · Computer Science 2025-09-15 Taero Kim , Subeen Park , Sungjun Lim , Yonghan Jung , Krikamol Muandet , Kyungwoo Song

Dynamic graph neural networks (DyGNNs) have demonstrated powerful predictive abilities by exploiting graph structural and temporal dynamics. However, the existing DyGNNs fail to handle distribution shifts, which naturally exist in dynamic…

Machine Learning · Computer Science 2024-03-11 Zeyang Zhang , Xin Wang , Ziwei Zhang , Haoyang Li , Wenwu Zhu

Graph neural networks (GNNs) have been demonstrated to perform well in graph representation learning, but always lacking in generalization capability when tackling out-of-distribution (OOD) data. Graph invariant learning methods, backed by…

Machine Learning · Computer Science 2023-12-19 Tianrui Jia , Haoyang Li , Cheng Yang , Tao Tao , Chuan Shi

Invariant graph representation learning aims to learn the invariance among data from different environments for out-of-distribution generalization on graphs. As the graph environment partitions are usually expensive to obtain, augmenting…

Machine Learning · Computer Science 2023-10-31 Yongqiang Chen , Yatao Bian , Kaiwen Zhou , Binghui Xie , Bo Han , James Cheng

Graph Out-of-Distribution (OOD), requiring that models trained on biased data generalize to the unseen test data, has considerable real-world applications. One of the most mainstream methods is to extract the invariant subgraph by aligning…

Machine Learning · Computer Science 2024-07-23 Xuexin Chen , Ruichu Cai , Kaitao Zheng , Zhifan Jiang , Zhengting Huang , Zhifeng Hao , Zijian Li

Node classification has gained significant importance in graph deep learning with real-world applications such as recommendation systems, drug discovery, and citation networks. Graph Convolutional Networks and Graph Transformers have…

Social and Information Networks · Computer Science 2025-04-04 Aman Singh , Shahid Shafi Dar , Ranveer Singh , Nagendra Kumar

Graph Neural Networks (GNNs) have achieved state-of-the-art performance in solving graph classification tasks. However, most GNN architectures aggregate information from all nodes and edges in a graph, regardless of their relevance to the…

Machine Learning · Statistics 2024-04-19 Pablo Sanchez-Martin , Kinaan Aamir Khan , Isabel Valera

Out-of-distribution generalization is a common problem that expects the model to perform well in the different distributions even far from the train data. A popular approach to addressing this issue is invariant learning (IL), in which the…

Machine Learning · Computer Science 2025-05-23 Jiaqi Wang , Yuhang Zhou , Zhixiong Zhang , Qiguang Chen , Yongqiang Chen , James Cheng
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