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This study aims to build a pre-trained Graph Neural Network (GNN) model on molecules without human annotations or prior knowledge. Although various attempts have been proposed to overcome limitations in acquiring labeled molecules, the…

机器学习 · 计算机科学 2024-12-23 Van Thuy Hoang , O-Joun Lee

Graph self-supervised learning seeks to learn effective graph representations without relying on labeled data. Among various approaches, graph autoencoders (GAEs) have gained significant attention for their efficiency and scalability.…

机器学习 · 计算机科学 2025-06-17 Yang Liu , Deyu Bo , Wenxuan Cao , Yuan Fang , Yawen Li , Chuan Shi

Graph neural networks (GNN) have recently emerged as a vehicle for applying deep network architectures to graph and relational data. However, given the increasing size of industrial datasets, in many practical situations the message passing…

机器学习 · 计算机科学 2021-11-16 Qingru Zhang , David Wipf , Quan Gan , Le Song

We introduce a binary embedding framework, called Proximity Preserving Code (PPC), which learns similarity and dissimilarity between data points to create a compact and affinity-preserving binary code. This code can be used to apply fast…

机器学习 · 计算机科学 2020-02-06 Inbal Lav , Shai Avidan , Yoram Singer , Yacov Hel-Or

In the modern age of social media and networks, graph representations of real-world phenomena have become an incredibly useful source to mine insights. Often, we are interested in understanding how entities in a graph are interconnected.…

机器学习 · 计算机科学 2021-12-16 Aneesh Komanduri , Justin Zhan

Graph Convolution Networks (GCNs) manifest great potential in recommendation. This is attributed to their capability on learning good user and item embeddings by exploiting the collaborative signals from the high-order neighbors. Like other…

信息检索 · 计算机科学 2021-03-30 Fan Liu , Zhiyong Cheng , Lei Zhu , Zan Gao , Liqiang Nie

We present Graph Attention Collaborative Similarity Embedding (GACSE), a new recommendation framework that exploits collaborative information in the user-item bipartite graph for representation learning. Our framework consists of two parts:…

信息检索 · 计算机科学 2021-02-08 Jinbo Song , Chao Chang , Fei Sun , Zhenyang Chen , Guoyong Hu , Peng Jiang

Graph convolutional networks (GCNs) have been successfully applied in node classification tasks of network mining. However, most of these models based on neighborhood aggregation are usually shallow and lack the "graph pooling" mechanism,…

社会与信息网络 · 计算机科学 2019-06-11 Fenyu Hu , Yanqiao Zhu , Shu Wu , Liang Wang , Tieniu Tan

With the increase in the number of image data and the lack of corresponding labels, weakly supervised learning has drawn a lot of attention recently in computer vision tasks, especially in the fine-grained semantic segmentation problem. To…

计算机视觉与模式识别 · 计算机科学 2021-10-11 Ke Zhang , Sihong Chen , Qi Ju , Yong Jiang , Yucong Li , Xin He

Graph Neural Networks (GNNs) have led to state-of-the-art performance on a variety of machine learning tasks such as recommendation, node classification and link prediction. Graph neural network models generate node embeddings by merging…

机器学习 · 计算机科学 2020-11-04 Yunpeng Weng , Xu Chen , Liang Chen , Wei Liu

The k-nearest neighbors (kNN) algorithm is a cornerstone of non-parametric classification in artificial intelligence, yet its deployment in large-scale applications is persistently constrained by the computational trade-off between…

机器学习 · 计算机科学 2026-01-26 Jiaye Li , Gang Chen , Hang Xu , Shichao Zhang

Graph coarsening reduces the size of a graph while preserving certain properties. Most existing methods preserve either spectral or spatial characteristics. Recent research has shown that preserving topological features helps maintain the…

机器学习 · 计算机科学 2026-02-02 Xiang Wu , Rong-Hua Li , Xunkai Li , Kangfei Zhao , Hongchao Qin , Guoren Wang

Training deep graph neural networks (GNNs) is notoriously hard. Besides the standard plights in training deep architectures such as vanishing gradients and overfitting, it also uniquely suffers from over-smoothing, information squashing,…

机器学习 · 计算机科学 2022-05-10 Tianlong Chen , Kaixiong Zhou , Keyu Duan , Wenqing Zheng , Peihao Wang , Xia Hu , Zhangyang Wang

Graph neural networks (GNNs) have drawn significant research attention recently, mostly under the setting of semi-supervised learning. When task-agnostic representations are preferred or supervision is simply unavailable, the auto-encoder…

机器学习 · 计算机科学 2022-02-21 Mingyue Tang , Carl Yang , Pan Li

Graph Convolutional Networks (GCNs) have become pivotal in recommendation systems for learning user and item embeddings by leveraging the user-item interaction graph's node information and topology. However, these models often face the…

信息检索 · 计算机科学 2024-04-23 Leilei Ding , Dazhong Shen , Chao Wang , Tianfu Wang , Le Zhang , Yanyong Zhang

Graph Neural Networks (GNNs) with numerical node features and graph structure as inputs have demonstrated superior performance on various supervised learning tasks with graph data. However the numerical node features utilized by GNNs are…

机器学习 · 计算机科学 2022-06-20 Jiuhai Chen , Jonas Mueller , Vassilis N. Ioannidis , Tom Goldstein , David Wipf

Spatial networks are useful for modeling geographic phenomena where spatial interaction plays an important role. To analyze the spatial networks and their internal structures, graph-based methods such as community detection have been widely…

社会与信息网络 · 计算机科学 2024-11-26 Yunlei Liang , Jiawei Zhu , Wen Ye , Song Gao

Semantic localization, i.e., robot self-localization with semantic image modality, is critical in recently emerging embodied AI applications (e.g., point-goal navigation, object-goal navigation, vision language navigation) and topological…

计算机视觉与模式识别 · 计算机科学 2023-12-27 Mitsuki Yoshida , Kanji Tanaka , Ryogo Yamamoto , Daiki Iwata

We consider graph representation learning in a self-supervised manner. Graph neural networks (GNNs) use neighborhood aggregation as a core component that results in feature smoothing among nodes in proximity. While successful in various…

机器学习 · 计算机科学 2021-07-20 Wei Zhuo , Guang Tan

Graph neural network(GNN) has been a powerful approach in collaborative filtering(CF) due to its ability to model high-order user-item relationships. Recently, to alleviate the data sparsity and enhance representation learning, many efforts…

信息检索 · 计算机科学 2024-12-10 Bowen Zheng , Junjie Zhang , Hongyu Lu , Yu Chen , Ming Chen , Wayne Xin Zhao , Ji-Rong Wen