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Classical supervised learning produces unreliable models when training and target distributions differ, with most existing solutions requiring samples from the target domain. We propose a proactive approach which learns a relationship in…

Machine Learning · Statistics 2019-03-01 Adarsh Subbaswamy , Peter Schulam , Suchi Saria

Dynamic interaction graphs have been widely adopted to model the evolution of user-item interactions over time. There are two crucial factors when modelling user preferences for link prediction in dynamic interaction graphs: 1)…

Machine Learning · Computer Science 2022-12-29 Jiahao Liu , Dongsheng Li , Hansu Gu , Tun Lu , Peng Zhang , Ning Gu

Can neural networks learn to compare graphs without feature engineering? In this paper, we show that it is possible to learn representations for graph similarity with neither domain knowledge nor supervision (i.e.\ feature engineering or…

Machine Learning · Computer Science 2019-04-23 Rami Al-Rfou , Dustin Zelle , Bryan Perozzi

The topological (or graph) structures of real-world networks are known to be predictive of multiple dynamic properties of the networks. Conventionally, a graph structure is represented using an adjacency matrix or a set of hand-crafted…

Social and Information Networks · Computer Science 2016-10-21 Cheng Li , Xiaoxiao Guo , Qiaozhu Mei

Accurate multistep forecasting of node-level attributes on dynamic graphs is critical for applications ranging from financial trust networks to biological networks. Existing spatiotemporal graph neural networks typically assume a static…

Machine Learning · Computer Science 2026-05-20 Namrata Banerji , Tanya Berger-Wolf

As a data-driven method, the performance of deep convolutional neural networks (CNN) relies heavily on training data. The prediction results of traditional networks give a bias toward larger classes, which tend to be the background in the…

Computer Vision and Pattern Recognition · Computer Science 2022-03-04 N. Anantrasirichai , David Bull

Modeling complex spatiotemporal dependencies in correlated traffic series is essential for traffic prediction. While recent works have shown improved prediction performance by using neural networks to extract spatiotemporal correlations,…

Machine Learning · Computer Science 2023-09-08 Junpeng Lin , Ziyue Li , Zhishuai Li , Lei Bai , Rui Zhao , Chen Zhang

Traffic forecasting is important in intelligent transportation systems of webs and beneficial to traffic safety, yet is very challenging because of the complex and dynamic spatio-temporal dependencies in real-world traffic systems. Prior…

Machine Learning · Computer Science 2021-12-07 Yuchen Fang , Yanjun Qin , Haiyong Luo , Fang Zhao , Liang Zeng , Bo Hui , Chenxing Wang

Graph property prediction tasks are important and numerous. While each task offers a small size of labeled examples, unlabeled graphs have been collected from various sources and at a large scale. A conventional approach is training a model…

Machine Learning · Computer Science 2023-10-13 Gang Liu , Eric Inae , Tong Zhao , Jiaxin Xu , Tengfei Luo , Meng Jiang

We study the temporal reconstruction of epidemics evolving over networks. Given partial or aggregated temporal information of the epidemic, our goal is to estimate the complete evolution of the spread leveraging the topology of the network…

Signal Processing · Electrical Eng. & Systems 2020-11-20 Gojko Cutura , Boning Li , Ananthram Swami , Santiago Segarra

Graph embedding, aiming to learn low-dimensional representations (aka. embeddings) of nodes, has received significant attention recently. Recent years have witnessed a surge of efforts made on static graphs, among which Graph Convolutional…

Machine Learning · Computer Science 2021-04-08 Zeyu Cui , Zekun Li , Shu Wu , Xiaoyu Zhang , Qiang Liu , Liang Wang , Mengmeng Ai

Predicting the docking between proteins and ligands is a crucial and challenging task for drug discovery. However, traditional docking methods mainly rely on scoring functions, and deep learning-based docking approaches usually neglect the…

Biomolecules · Quantitative Biology 2026-01-06 Yiqiang Yi , Xu Wan , Yatao Bian , Le Ou-Yang , Peilin Zhao

We show that deep learning models, and especially architectures like the Transformer, originally intended for natural language, can be trained on randomly generated datasets to predict to very high accuracy both the qualitative and…

Machine Learning · Computer Science 2021-12-08 François Charton , Amaury Hayat , Sean T. McQuade , Nathaniel J. Merrill , Benedetto Piccoli

Contrastive learning has shown to learn better quality representations than models trained using cross-entropy loss. They also transfer better to downstream datasets from different domains. However, little work has been done to explore the…

Computer Vision and Pattern Recognition · Computer Science 2023-09-28 Alvin De Jun Tan , Clement Tan , Chai Kiat Yeo

State-of-the-art Deep Neural Networks (DNNs) often incorporate multi-branch connections, enabling multi-scale feature extraction and enhancing the capture of diverse features. This design improves network capacity and generalisation to…

Neural and Evolutionary Computing · Computer Science 2025-06-26 Fergal Stapleton , Daniel García Núñez , Yanan Sun , Edgar Galván

Representing entities and relations in an embedding space is a well-studied approach for machine learning on relational data. Existing approaches, however, primarily focus on improving accuracy and overlook other aspects such as robustness…

Machine Learning · Computer Science 2019-05-03 Pouya Pezeshkpour , Yifan Tian , Sameer Singh

Predicting pedestrian motion trajectories is crucial for path planning and motion control of autonomous vehicles. Accurately forecasting crowd trajectories is challenging due to the uncertain nature of human motions in different…

Computer Vision and Pattern Recognition · Computer Science 2024-01-11 Yu Liu , Yuexin Zhang , Kunming Li , Yongliang Qiao , Stewart Worrall , You-Fu Li , He Kong

Social robot navigation can be helpful in various contexts of daily life but requires safe human-robot interactions and efficient trajectory planning. While modeling pairwise relations has been widely studied in multi-agent interacting…

Robotics · Computer Science 2024-11-13 Jiachen Li , Chuanbo Hua , Jianpeng Yao , Hengbo Ma , Jinkyoo Park , Victoria Dax , Mykel J. Kochenderfer

Learning topological representation of a network in dynamic environments has recently attracted considerable attention due to the time-evolving nature of many real-world networks i.e. nodes/links might be added/removed as time goes on.…

Social and Information Networks · Computer Science 2019-07-30 Chengbin Hou , Han Zhang , Ke Tang , Shan He

Dynamic Link Prediction (DLP) addresses the prediction of future links in evolving networks. However, accurately portraying the performance of DLP algorithms poses challenges that might impede progress in the field. Importantly, common…

Social and Information Networks · Computer Science 2024-05-28 Raphaël Romero , Maarten Buyl , Tijl De Bie , Jefrey Lijffijt