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With growing demand for interpretability in deep learning, especially in high stakes domains, Concept Bottleneck Models (CBMs) address this by inserting human understandable concepts into the prediction pipeline, but they are generally…

计算机视觉与模式识别 · 计算机科学 2025-10-02 Jiakai Lin , Jinchang Zhang , Guoyu Lu

Graph Neural Networks (GNNs) have been widely used for the representation learning of various structured graph data. While promising, most existing GNNs oversimplified the complexity and diversity of the edges in the graph, and thus…

机器学习 · 计算机科学 2021-10-07 Hao Peng , Ruitong Zhang , Yingtong Dou , Renyu Yang , Jingyi Zhang , Philip S. Yu

In recent years, the advancement of Graph Neural Networks (GNNs) has significantly propelled progress in Multi-View Clustering (MVC). However, existing methods face the problem of coarse-grained graph fusion. Specifically, current…

计算机视觉与模式识别 · 计算机科学 2026-03-25 Jian Zhu , Xin Zou , Jun Sun , Cheng Luo , Lei Liu , Lingfang Zeng , Ning Zhang , Bian Wu , Chang Tang , Lirong Dai

The rapid development of Multimodal Large Language Models (MLLMs) has enabled the integration of multiple modalities, including texts and images, within the large language model (LLM) framework. However, texts and images are usually…

人工智能 · 计算机科学 2025-03-11 Yi Fang , Bowen Jin , Jiacheng Shen , Sirui Ding , Qiaoyu Tan , Jiawei Han

Over the past two decades, recommendation systems (RSs) have used machine learning (ML) solutions to recommend items, e.g., movies, books, and restaurants, to clients of a business or an online platform. Recipe recommendation, however, has…

信息检索 · 计算机科学 2023-08-10 Ali Pesaranghader , Touqir Sajed

Mixture-of-experts (MoE) architectures used in large language models (LLMs) achieve state-of-the-art performance across diverse tasks yet face practical challenges such as deployment complexity and low activation efficiency. Expert pruning…

机器学习 · 计算机科学 2025-12-23 Xican Yang , Yuanhe Tian , Yan Song

Graph neural networks (GNNs) have drawn increasing attention in recent years and achieved remarkable performance in many graph-based tasks, especially in semi-supervised learning on graphs. However, most existing GNNs are based on the…

机器学习 · 计算机科学 2024-01-24 Li Zhou , Wenyu Chen , Dingyi Zeng , Shaohuan Cheng , Wanlong Liu , Malu Zhang , Hong Qu

Partial Differential Equations (PDEs) underpin many scientific phenomena, yet traditional computational approaches often struggle with complex, nonlinear systems and irregular geometries. This paper introduces the AMG method, a Multi-Graph…

机器学习 · 计算机科学 2025-02-10 Zhihao Li , Haoze Song , Di Xiao , Zhilu Lai , Wei Wang

Multimodal brain networks characterize complex connectivities among different brain regions from both structural and functional aspects and provide a new means for mental disease analysis. Recently, Graph Neural Networks (GNNs) have become…

神经元与认知 · 定量生物学 2022-05-25 Yanqiao Zhu , Hejie Cui , Lifang He , Lichao Sun , Carl Yang

Graph neural networks (GNNs) demonstrate a robust capability for representation learning on graphs with complex structures, showcasing superior performance in various applications. The majority of existing GNNs employ a graph convolution…

机器学习 · 计算机科学 2025-02-19 Jinlu Wang , Jipeng Guo , Yanfeng Sun , Junbin Gao , Shaofan Wang , Yachao Yang , Baocai Yin

Knowledge Graph (KG) reasoning, which aims to infer new facts from structured knowledge repositories, plays a vital role in Natural Language Processing (NLP) systems. Its effectiveness critically depends on constructing informative and…

机器学习 · 计算机科学 2025-08-26 Enjun Du , Siyi Liu , Yongqi Zhang

The performance analytics domain in High Performance Computing (HPC) uses tabular data to solve regression problems, such as predicting the execution time. Existing Machine Learning (ML) techniques leverage the correlations among features…

机器学习 · 计算机科学 2024-01-22 Tarek Ramadan , Ankur Lahiry , Tanzima Z. Islam

Molecular Machine Learning (ML) bears promise for efficient molecule property prediction and drug discovery. However, labeled molecule data can be expensive and time-consuming to acquire. Due to the limited labeled data, it is a great…

机器学习 · 计算机科学 2022-04-01 Yuyang Wang , Jianren Wang , Zhonglin Cao , Amir Barati Farimani

Graph Neural Networks (GNNs) have achieved great successes in many learning tasks performed on graph structures. Nonetheless, to propagate information GNNs rely on a message passing scheme which can become prohibitively expensive when…

机器学习 · 计算机科学 2022-11-09 Ariel R. Ramos Vela , Johannes F. Lutzeyer , Anastasios Giovanidis , Michalis Vazirgiannis

Molecular property prediction is essential for applications such as drug discovery and toxicity assessment. While Graph Neural Networks (GNNs) have shown promising results by modeling molecules as molecular graphs, their reliance on…

机器学习 · 计算机科学 2025-04-09 Tianyi Jiang , Zeyu Wang , Shanqing Yu , Qi Xuan

Graph representation learning methods are highly effective in handling complex non-Euclidean data by capturing intricate relationships and features within graph structures. However, traditional methods face challenges when dealing with…

机器学习 · 计算机科学 2025-02-25 Hang Gao , Chenhao Zhang , Fengge Wu , Junsuo Zhao , Changwen Zheng , Huaping Liu

Molecular graph neural networks (GNNs) often focus exclusively on XYZ-based geometric representations and thus overlook valuable chemical context available in public databases like PubChem. This work introduces a multimodal framework that…

机器学习 · 计算机科学 2025-05-20 Can Polat , Hasan Kurban , Erchin Serpedin , Mustafa Kurban

Graph Neural Networks (GNNs) have become a dominant approach to learning graph representations, primarily because of their message-passing mechanisms. However, GNNs typically adopt a fixed aggregator function such as Mean, Max, or Sum…

机器学习 · 计算机科学 2025-07-29 Xuanting Xie , Bingheng Li , Erlin Pan , Zhao Kang , Wenyu Chen

Graph Neural Networks (GNNs) are powerful techniques in representation learning for graphs and have been increasingly deployed in a multitude of different applications that involve node- and graph-wise tasks. Most existing studies solve…

人工智能 · 计算机科学 2022-03-21 Zhiqiang Zhong , Cheng-Te Li , Jun Pang

Graph-based multi-view clustering aiming to obtain a partition of data across multiple views, has received considerable attention in recent years. Although great efforts have been made for graph-based multi-view clustering, it remains a…

计算机视觉与模式识别 · 计算机科学 2022-11-11 Yiming Wang , Dongxia Chang , Zhiqiang Fu , Yao Zhao