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Graph neural networks have become a powerful framework for learning complex structure-property relationships and fast screening of chemical compounds. Recently proposed methods have demonstrated that using 3D geometry information of the…

生物大分子 · 定量生物学 2022-03-10 Ali Raza , E. Adrian Henle , Xiaoli Fern

Tracking of objects in 3D is a fundamental task in computer vision that finds use in a wide range of applications such as autonomous driving, robotics or augmented reality. Most recent approaches for 3D multi object tracking (MOT) from…

计算机视觉与模式识别 · 计算机科学 2021-04-26 Jan-Nico Zaech , Dengxin Dai , Alexander Liniger , Martin Danelljan , Luc Van Gool

3D Multi-object tracking (MOT) is crucial to autonomous systems. Recent work uses a standard tracking-by-detection pipeline, where feature extraction is first performed independently for each object in order to compute an affinity matrix.…

计算机视觉与模式识别 · 计算机科学 2020-06-15 Xinshuo Weng , Yongxin Wang , Yunze Man , Kris Kitani

Graph transformers are a recent advancement in machine learning, offering a new class of neural network models for graph-structured data. The synergy between transformers and graph learning demonstrates strong performance and versatility…

机器学习 · 计算机科学 2025-12-23 Ahsan Shehzad , Feng Xia , Shagufta Abid , Ciyuan Peng , Shuo Yu , Dongyu Zhang , Karin Verspoor

Graph is a fundamental data structure to model interconnections between entities. Set, on the contrary, stores independent elements. To learn graph representations, current Graph Neural Networks (GNNs) primarily use message passing to…

机器学习 · 计算机科学 2024-06-03 Xiyuan Wang , Pan Li , Muhan Zhang

The design of Graph Transformers (GTs) generally neglects considerations for fairness, resulting in biased outcomes against certain sensitive subgroups. Since GTs encode graph information without relying on message-passing mechanisms,…

机器学习 · 计算机科学 2024-04-29 Renqiang Luo , Huafei Huang , Shuo Yu , Xiuzhen Zhang , Feng Xia

Transformer-based architectures have become the dominant paradigm for Continuous-Time Dynamic Graph (CTDG) learning, yet their performance remains limited on temporally shifted datasets. In this work, we identify attention dispersion as a…

机器学习 · 计算机科学 2026-05-18 Jinhao Zhang , Kangfei Zhao , Qiuhao Zeng , Long-Kai Huang

Intelligent service robots require the ability to perform a variety of tasks in dynamic environments. Despite the significant progress in robotic grasping, it is still a challenge for robots to decide grasping position when given different…

机器人学 · 计算机科学 2021-11-30 Ming Sun , Yue Gao

Nowadays, transformer networks have demonstrated superior performance in many computer vision tasks. In a multi-view 3D reconstruction algorithm following this paradigm, self-attention processing has to deal with intricate image tokens…

计算机视觉与模式识别 · 计算机科学 2023-08-21 Liying Yang , Zhenwei Zhu , Xuxin Lin , Jian Nong , Yanyan Liang

Graphs are a commonly used construct for representing relationships between elements in complex high dimensional datasets. Many real-world phenomenon are dynamic in nature, meaning that any graph used to represent them is inherently…

社会与信息网络 · 计算机科学 2018-11-21 Stephen Bonner , John Brennan , Ibad Kureshi , Georgios Theodoropoulos , Andrew Stephen McGough , Boguslaw Obara

By incorporating the graph structural information into Transformers, graph Transformers have exhibited promising performance for graph representation learning in recent years. Existing graph Transformers leverage specific strategies, such…

机器学习 · 计算机科学 2022-11-16 Gaichao Li , Jinsong Chen , Kun He

We present graph attention networks (GATs), novel neural network architectures that operate on graph-structured data, leveraging masked self-attentional layers to address the shortcomings of prior methods based on graph convolutions or…

While next-token prediction (NTP) has been the standard objective for training language models, it often struggles to capture global structure in reasoning tasks. Multi-token prediction (MTP) has recently emerged as a promising alternative,…

机器学习 · 计算机科学 2026-04-15 Jianhao Huang , Zhanpeng Zhou , Renqiu Xia , Baharan Mirzasoleiman , Weijie Su , Wei Huang

Recent development of deep neural networks (DNNs) for tabular learning has largely benefited from the capability of DNNs for automatic feature interaction. However, the heterogeneity nature of tabular features makes such features relatively…

机器学习 · 计算机科学 2023-03-07 Jiahuan Yan , Jintai Chen , Yixuan Wu , Danny Z. Chen , Jian Wu

Graph representation learning methods have been widely adopted in financial applications to enhance company representations by leveraging inter-firm relationships. However, current approaches face three key challenges: (1) The advantages of…

统计金融 · 定量金融 2025-07-04 Yingjie Niu , Mingchuan Zhao , Valerio Poti , Ruihai Dong

How to obtain informative representations of molecules is a crucial prerequisite in AI-driven drug design and discovery. Recent researches abstract molecules as graphs and employ Graph Neural Networks (GNNs) for molecular representation…

生物大分子 · 定量生物学 2020-10-30 Yu Rong , Yatao Bian , Tingyang Xu , Weiyang Xie , Ying Wei , Wenbing Huang , Junzhou Huang

Automatic generation of ophthalmic reports using data-driven neural networks has great potential in clinical practice. When writing a report, ophthalmologists make inferences with prior clinical knowledge. This knowledge has been neglected…

计算机视觉与模式识别 · 计算机科学 2022-06-07 Mingjie Li , Wenjia Cai , Karin Verspoor , Shirui Pan , Xiaodan Liang , Xiaojun Chang

We show that standard Transformers without graph-specific modifications can lead to promising results in graph learning both in theory and practice. Given a graph, we simply treat all nodes and edges as independent tokens, augment them with…

机器学习 · 计算机科学 2022-10-25 Jinwoo Kim , Tien Dat Nguyen , Seonwoo Min , Sungjun Cho , Moontae Lee , Honglak Lee , Seunghoon Hong

Transformer architectures, capable of capturing sequential dependencies in the history of user interactions, have become the dominant approach in sequential recommender systems. Despite their success, such models consider sequence elements…

Structural knowledge graph foundation models aim to generalize reasoning to completely new graphs with unseen entities and relations. A key limitation of existing approaches like Ultra is their reliance on a single relational transformation…

人工智能 · 计算机科学 2025-12-30 Ling Xin , Mojtaba Nayyeri , Zahra Makki Nayeri , Steffen Staab