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The electric grid is a key enabling infrastructure for the ambitious transition towards carbon neutrality as we grapple with climate change. With deepening penetration of renewable energy resources and electrified transportation, the…

Machine Learning · Computer Science 2022-05-24 Xiangtian Zheng , Nan Xu , Loc Trinh , Dongqi Wu , Tong Huang , S. Sivaranjani , Yan Liu , Le Xie

Predicting materials properties from composition or structure is of great interest to the materials science community. Deep learning has recently garnered considerable interest in materials predictive tasks with low model errors when…

Materials Science · Physics 2021-11-01 Chi Chen , Shyue Ping Ong

Modeling the structure and events of the physical world constitutes a fundamental objective of neural networks. Among the diverse approaches, Graph Network Simulators (GNS) have emerged as the leading method for modeling physical phenomena,…

Computer Vision and Pattern Recognition · Computer Science 2024-10-07 Sheng Yang , Fengge Wu , Junsuo Zhao

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…

Computer Vision and Pattern Recognition · Computer Science 2025-10-02 Jiakai Lin , Jinchang Zhang , Guoyu Lu

This paper focuses on the statistical analysis of shapes of data objects called shape graphs, a set of nodes connected by articulated curves with arbitrary shapes. A critical need here is a constrained registration of points (nodes to…

Computer Vision and Pattern Recognition · Computer Science 2023-08-15 Shenyuan Liang , Mauricio Pamplona Segundo , Sathyanarayanan N. Aakur , Sudeep Sarkar , Anuj Srivastava

Inferring the graph structure from observed data is a key task in graph machine learning to capture the intrinsic relationship between data entities. While significant advancements have been made in learning the structure of homogeneous…

Machine Learning · Computer Science 2025-03-13 Keyue Jiang , Bohan Tang , Xiaowen Dong , Laura Toni

Parametric point clouds are sampled from CAD shapes and are becoming increasingly common in industrial manufacturing. Most CAD-specific deep learning methods focus on geometric features, while overlooking constraints inherent in CAD shapes.…

Computer Vision and Pattern Recognition · Computer Science 2025-07-23 Xi Cheng , Ruiqi Lei , Di Huang , Zhichao Liao , Fengyuan Piao , Yan Chen , Pingfa Feng , Long Zeng

Recently, cross-spectral image patch matching based on feature relation learning has attracted extensive attention. However, performance bottleneck problems have gradually emerged in existing methods. To address this challenge, we make the…

Computer Vision and Pattern Recognition · Computer Science 2024-12-17 Chuang Yu , Yunpeng Liu , Jinmiao Zhao , Xiangyu Yue

Hypergraphs are used to model higher-order interactions amongst agents and there exist many practically relevant instances of hypergraph datasets. To enable efficient processing of hypergraph-structured data, several hypergraph neural…

Machine Learning · Computer Science 2022-03-29 Eli Chien , Chao Pan , Jianhao Peng , Olgica Milenkovic

Recently, graph neural networks (GNNs) have proved to be suitable in tasks on unstructured data. Particularly in tasks as community detection, node classification, and link prediction. However, most GNN models still operate with static…

Machine Learning · Computer Science 2019-06-07 Darwin Saire Pilco , Adín Ramírez Rivera

Graphs are a widely used paradigm for representing non-Euclidean data, with applications ranging from social network analysis to biomolecular prediction. While graph learning has achieved remarkable progress, real-world graph data presents…

A large number of real-world graphs or networks are inherently heterogeneous, involving a diversity of node types and relation types. Heterogeneous graph embedding is to embed rich structural and semantic information of a heterogeneous…

Social and Information Networks · Computer Science 2020-04-01 Xinyu Fu , Jiani Zhang , Ziqiao Meng , Irwin King

Set-based learning is an essential component of modern deep learning and network science. Graph Neural Networks (GNNs) and their edge-free counterparts Deepsets have proven remarkably useful on ragged and topologically challenging datasets.…

Machine Learning · Computer Science 2024-07-01 T. Lucas Makinen , Justin Alsing , Benjamin D. Wandelt

This paper introduces a novel deep learning based method, named bridge neural network (BNN) to dig the potential relationship between two given data sources task by task. The proposed approach employs two convolutional neural networks that…

Machine Learning · Computer Science 2019-06-27 Yao Xu , Xueshuang Xiang , Meiyu Huang

The robotic systems continuously interact with complex dynamical systems in the physical world. Reliable predictions of spatiotemporal evolution of these dynamical systems, with limited knowledge of system dynamics, are crucial for…

Artificial Intelligence · Computer Science 2019-01-08 Yun Long , Xueyuan She , Saibal Mukhopadhyay

One of the ways to train deep neural networks effectively is to use residual connections. Residual connections can be classified as being either identity connections or bridge-connections with a reshaping convolution. Empirical observations…

Machine Learning · Computer Science 2019-02-19 Varshaneya V , Balasubramanian S , Darshan Gera

There is growing interest in using machine learning (ML) methods for structural metamodeling due to the substantial computational cost of traditional simulations. Purely data-driven strategies often face limitations in model robustness,…

Applied Physics · Physics 2024-04-30 R. Bailey Bond , Pu Ren , Jerome F. Hajjar , Hao Sun

The Internet is composed of networks, called Autonomous Systems (or, ASes), interconnected to each other, thus forming a large graph. While both the AS-graph is known and there is a multitude of data available for the ASes (i.e., node…

Networking and Internet Architecture · Computer Science 2022-10-26 Dimitrios Panteleimon Giakatos , Sofia Kostoglou , Pavlos Sermpezis , Athena Vakali

We present the Open Graph Benchmark (OGB), a diverse set of challenging and realistic benchmark datasets to facilitate scalable, robust, and reproducible graph machine learning (ML) research. OGB datasets are large-scale, encompass multiple…

Machine Learning · Computer Science 2021-02-26 Weihua Hu , Matthias Fey , Marinka Zitnik , Yuxiao Dong , Hongyu Ren , Bowen Liu , Michele Catasta , Jure Leskovec

Machine learning (ML) offers transformative potential for computational fluid dynamics (CFD), promising to accelerate simulations, improve turbulence modelling, and enable real-time flow prediction and control-capabilities that could…

Fluid Dynamics · Physics 2026-02-24 Zachary Cooper-Baldock , Paulo E. Santos , Russell S. A. Brinkworth , Karl Sammut
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