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Learning the mapping between two function spaces has garnered considerable research attention. However, learning the solution operator of partial differential equations (PDEs) remains a challenge in scientific computing. Fourier neural…

机器学习 · 计算机科学 2024-03-05 Jin Young Shin , Jae Yong Lee , Hyung Ju Hwang

Accurate sensing of spatially distributed physical fields typically requires dense instrumentation, which is often infeasible in real-world systems due to cost, accessibility, and environmental constraints. Physics-based solvers address…

Solving parametric partial differential equations (PDEs) and associated PDE-based, inverse problems is a central task in engineering and physics, yet existing neural operator methods struggle with high-dimensional, discontinuous inputs and…

机器学习 · 计算机科学 2025-07-03 Yaohua Zang , Phaedon-Stelios Koutsourelakis

Most compilers for machine learning (ML) frameworks need to solve many correlated optimization problems to generate efficient machine code. Current ML compilers rely on heuristics based algorithms to solve these optimization problems one at…

This paper presents a novel transformer architecture for graph representation learning. The core insight of our method is to fully consider the information propagation among nodes and edges in a graph when building the attention module in…

机器学习 · 计算机科学 2024-10-10 Zhe Chen , Hao Tan , Tao Wang , Tianrun Shen , Tong Lu , Qiuying Peng , Cheng Cheng , Yue Qi

This paper introduces a data-driven operator learning method for multiscale partial differential equations, with a particular emphasis on preserving high-frequency information. Drawing inspiration from the representation of multiscale…

机器学习 · 计算机科学 2024-08-05 Bo Xu , Xinliang Liu , Lei Zhang

Generalizing a pretrained model to unseen datasets without retraining is an essential step toward a foundation model. However, achieving such cross-dataset, fully inductive inference is difficult in graph-structured data where feature…

机器学习 · 计算机科学 2025-12-15 Dooho Lee , Myeong Kong , Minho Jeong , Jaemin Yoo

Graph Neural Networks (GNNs) with equivariant properties have emerged as powerful tools for modeling complex dynamics of multi-object physical systems. However, their generalization ability is limited by the inadequate consideration of…

机器学习 · 计算机科学 2024-03-13 Yang Liu , Jiashun Cheng , Haihong Zhao , Tingyang Xu , Peilin Zhao , Fugee Tsung , Jia Li , Yu Rong

Graph Transformer is gaining increasing attention in the field of machine learning and has demonstrated state-of-the-art performance on benchmarks for graph representation learning. However, as current implementations of Graph Transformer…

机器学习 · 计算机科学 2023-05-08 Wenhao Zhu , Tianyu Wen , Guojie Song , Xiaojun Ma , Liang Wang

Engineering design problems often involve solving parametric Partial Differential Equations (PDEs) under variable PDE parameters and domain geometry. Recently, neural operators have shown promise in learning PDE operators and quickly…

机器学习 · 计算机科学 2024-11-14 Weiheng Zhong , Hadi Meidani

High-quality surface normal can help improve geometry estimation in problems faced by autonomous vehicles, such as collision avoidance and occlusion inference. While a considerable volume of literature focuses on densely scanned indoor…

计算机视觉与模式识别 · 计算机科学 2025-02-13 Ancheng Lin , Jun Li , Yusheng Xiang , Wei Bian , Mukesh Prasad

We introduce ECHO, a transformer-operator framework for generating million-point PDE trajectories. While existing neural operators (NOs) have shown promise for solving partial differential equations, they remain limited in practice due to…

机器学习 · 计算机科学 2025-12-05 Armand Kassaï Koupaï , Lise Le Boudec , Patrick Gallinari

Graphs with complete node attributes have been widely explored recently. While in practice, there is a graph where attributes of only partial nodes could be available and those of the others might be entirely missing. This attribute-missing…

机器学习 · 计算机科学 2020-11-04 Xu Chen , Siheng Chen , Jiangchao Yao , Huangjie Zheng , Ya Zhang , Ivor W Tsang

Dynamic graph embedding has emerged as a very effective technique for addressing diverse temporal graph analytic tasks (i.e., link prediction, node classification, recommender systems, anomaly detection, and graph generation) in various…

机器学习 · 计算机科学 2023-12-27 Alan John Varghese , Aniruddha Bora , Mengjia Xu , George Em Karniadakis

Graph Neural Networks (GNNs) are powerful models that can manage complex data sources and their interconnection links. One of GNNs' main drawbacks is their lack of interpretability, which limits their application in sensitive fields. In…

机器学习 · 计算机科学 2026-03-24 Salvatore Calderaro , Domenico Amato , Giosuè Lo Bosco , Riccardo Rizzo , Filippo Vella

Graph Transformers have recently attracted attention for molecular property prediction by combining the inductive biases of graph neural networks (GNNs) with the global receptive field of Transformers. However, many existing hybrid…

机器学习 · 计算机科学 2026-04-09 Yi Yang , Ovidiu Daescu

The Monte Carlo-type Neural Operator (MCNO) introduces a framework for learning solution operators of one-dimensional partial differential equations (PDEs) by directly learning the kernel function and approximating the associated integral…

机器学习 · 计算机科学 2025-12-04 Salah Eddine Choutri , Prajwal Chauhan , Othmane Mazhar , Saif Eddin Jabari

Cardiac resynchronization therapy (CRT) is a common intervention for patients with dyssynchronous heart failure, yet approximately one-third of recipients fail to respond, partly due to suboptimal lead placement. Identifying optimal pacing…

计算工程、金融与科学 · 计算机科学 2026-02-13 Ehsan Naghavi , Haifeng Wang , Vahid Ziaei Rad , Julius Guccione , Ghassan Kassab , Vishnu Boddeti , Seungik Baek , Lik-Chuan Lee

Scientific computing using deep learning has seen significant advancements in recent years. There has been growing interest in models that learn the operator from the parameters of a partial differential equation (PDE) to the corresponding…

机器学习 · 计算机科学 2024-02-14 Sung Woong Cho , Jae Yong Lee , Hyung Ju Hwang

Many modern data analytics applications on graphs operate on domains where graph topology is not known a priori, and hence its determination becomes part of the problem definition, rather than serving as prior knowledge which aids the…