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In recent years, contrastive learning achieves impressive results on self-supervised visual representation learning, but there still lacks a rigorous understanding of its learning dynamics. In this paper, we show that if we cast a…

Machine Learning · Computer Science 2023-03-09 Yifei Wang , Qi Zhang , Tianqi Du , Jiansheng Yang , Zhouchen Lin , Yisen Wang

Message passing neural networks have shown a lot of success on graph-structured data. However, there are many instances where message passing can lead to over-smoothing or fail when neighboring nodes belong to different classes. In this…

Constructing appropriate representations of molecules lies at the core of numerous tasks such as material science, chemistry and drug designs. Recent researches abstract molecules as attributed graphs and employ graph neural networks (GNN)…

Machine Learning · Computer Science 2021-07-29 Jianwen Chen , Shuangjia Zheng , Ying Song , Jiahua Rao , Yuedong Yang

Heterogeneous graph neural networks (HGNNs) have significantly propelled the information retrieval (IR) field. Still, the effectiveness of HGNNs heavily relies on high-quality labels, which are often expensive to acquire. This challenge has…

Machine Learning · Computer Science 2024-09-12 Siqing Li , Jin-Duk Park , Wei Huang , Xin Cao , Won-Yong Shin , Zhiqiang Xu

Message passing is a fundamental procedure for graph neural networks in the field of graph representation learning. Based on the homophily assumption, the current message passing always aggregates features of connected nodes, such as the…

Machine Learning · Computer Science 2022-02-02 Jie Chen , Weiqi Liu , Jian Pu

This study utilizes community structures to address node degree biases in message-passing (MP) via learnable graph augmentations and novel graph transformers. Recent augmentation-based methods showed that MP neural networks often perform…

Machine Learning · Computer Science 2023-12-29 Van Thuy Hoang , O-Joun Lee

Learning by contrasting positive and negative samples is a general strategy adopted by many methods. Noise contrastive estimation (NCE) for word embeddings and translating embeddings for knowledge graphs are examples in NLP employing this…

Computation and Language · Computer Science 2018-08-06 Avishek Joey Bose , Huan Ling , Yanshuai Cao

Graph neural networks (GNNs) and message passing neural networks (MPNNs) have been proven to be expressive for subgraph structures in many applications. Some applications in heterogeneous graphs require explicit edge modeling, such as…

Machine Learning · Computer Science 2021-12-17 Xin Liu , Yangqiu Song

Knowledge graphs represent information as structured triples and serve as the backbone for a wide range of applications, including question answering, link prediction, and recommendation systems. A prominent line of research for exploring…

Machine Learning · Computer Science 2025-10-15 Rita T. Sousa , Heiko Paulheim

Unsupervised learning has recently made exceptional progress because of the development of more effective contrastive learning methods. However, CNNs are prone to depend on low-level features that humans deem non-semantic. This dependency…

Computer Vision and Pattern Recognition · Computer Science 2022-01-04 Songwei Ge , Shlok Mishra , Haohan Wang , Chun-Liang Li , David Jacobs

Despite recent advances in achieving fair representations and predictions through regularization, adversarial debiasing, and contrastive learning in graph neural networks (GNNs), the working mechanism (i.e., message passing) behind GNNs…

Machine Learning · Computer Science 2022-02-10 Zhimeng Jiang , Xiaotian Han , Chao Fan , Zirui Liu , Na Zou , Ali Mostafavi , Xia Hu

Gaussian and quadratic approximations of message passing algorithms on graphs have attracted considerable recent attention due to their computational simplicity, analytic tractability, and wide applicability in optimization and statistical…

Information Theory · Computer Science 2026-03-12 Sundeep Rangan , Alyson K. Fletcher , Vivek K. Goyal , Evan Byrne , Philip Schniter

One model of message delivery in a computer network is based on labelling each edge by a subset of a (reasonably small) universal set, and then encoding a path as the union of the labels of its edges. Earlier work suggested using random…

Combinatorics · Mathematics 2018-06-26 Gokce Caylak Kayaturan , Alexei Vernitski

Graph Neural Networks (GNNs) have demonstrated strong performance in graph mining tasks due to their message-passing mechanism, which is aligned with the homophily assumption that adjacent nodes exhibit similar behaviors. However, in many…

Machine Learning · Computer Science 2024-05-29 Zhuonan Zheng , Yuanchen Bei , Sheng Zhou , Yao Ma , Ming Gu , HongJia XU , Chengyu Lai , Jiawei Chen , Jiajun Bu

Graph Contrastive Learning (GCL) seeks to learn nodal or graph representations that contain maximal consistent information from graph-structured data. While node-level contrasting modes are dominating, some efforts commence to explore…

Machine Learning · Computer Science 2024-09-13 Zhenhao Zhao , Minhong Zhu , Chen Wang , Sijia Wang , Jiqiang Zhang , Li Chen , Weiran Cai

Graph contrastive learning (GCL) has been widely used as an effective self-supervised learning method for graph representation learning. However, how to apply adequate and stable graph augmentation to generating proper views for contrastive…

Machine Learning · Computer Science 2025-01-09 Yanchen Xu , Siqi Huang , Hongyuan Zhang , Xuelong Li

Recently, contrastive learning (CL) has emerged as a successful method for unsupervised graph representation learning. Most graph CL methods first perform stochastic augmentation on the input graph to obtain two graph views and maximize the…

Machine Learning · Computer Science 2021-03-01 Yanqiao Zhu , Yichen Xu , Feng Yu , Qiang Liu , Shu Wu , Liang Wang

Existing message passing neural networks for heterogeneous graphs rely on the concepts of meta-paths or meta-graphs due to the intrinsic nature of heterogeneous graphs. However, the meta-paths and meta-graphs need to be pre-configured…

Machine Learning · Computer Science 2022-10-27 Jiwoong Park , Jisu Jeong , Kyungmin Kim , Jin Young Choi

In this work, we discover that causal inference provides a promising approach to capture heterophilic message-passing in Graph Neural Network (GNN). By leveraging cause-effect analysis, we can discern heterophilic edges based on asymmetric…

Machine Learning · Computer Science 2024-11-28 Botao Wang , Jia Li , Heng Chang , Keli Zhang , Fugee Tsung

Graph contrastive learning is the state-of-the-art unsupervised graph representation learning framework and has shown comparable performance with supervised approaches. However, evaluating whether the graph contrastive learning is robust to…

Machine Learning · Computer Science 2022-01-28 Sixiao Zhang , Hongxu Chen , Xiangguo Sun , Yicong Li , Guandong Xu
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