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Computer simulation is an important tool for scientific progress, especially when lab experiments are either extremely costly and difficult or lack the required resolution. However, all of the simulation methods come with limitations. In…

Fluid Dynamics · Physics 2023-08-04 Edward R. Smith , Panagiotis E. Theodorakis

To make progress in science, we often build abstract representations of physical systems that meaningfully encode information about the systems. The representations learnt by most current machine learning techniques reflect statistical…

Multiphysics simulation, which models the interactions between multiple physical processes, and multi-component simulation of complex structures are critical in fields like nuclear and aerospace engineering. Previous studies use numerical…

Machine Learning · Computer Science 2026-01-21 Tao Zhang , Zhenhai Liu , Feipeng Qi , Yongjun Jiao , Tailin Wu

Process simulation is gaining attention for its ability to assess potential performance improvements and risks associated with business process changes. The existing literature presents various techniques, generally grounded in process…

Artificial Intelligence · Computer Science 2024-06-26 Rafael S. Oyamada , Gabriel M. Tavares , Sylvio Barbon Junior , Paolo Ceravolo

We propose a new family of neural networks to predict the behaviors of physical systems by learning their underpinning constraints. A neural projection operator lies at the heart of our approach, composed of a lightweight network with an…

Neural and Evolutionary Computing · Computer Science 2020-12-15 Shuqi Yang , Xingzhe He , Bo Zhu

Modern machine learning accelerators are designed to efficiently execute deep neural networks (DNNs) by optimizing data movement, memory hierarchy, and compute throughput. However, emerging DNN models such as large language models, state…

Hardware Architecture · Computer Science 2025-09-03 Shubham Negi , Manik Singhal , Aayush Ankit , Sudeep Bhoja , Kaushik Roy

Using representations of functional data can be more convenient and beneficial in subsequent statistical models than direct observations. These representations, in a lower-dimensional space, extract and compress information from individual…

Machine Learning · Statistics 2022-06-24 Haixu Wang , Jiguo Cao

We introduce Compositional Imitation Learning and Execution (CompILE): a framework for learning reusable, variable-length segments of hierarchically-structured behavior from demonstration data. CompILE uses a novel unsupervised,…

Developing effective multimodal data fusion strategies has become increasingly essential for improving the predictive power of statistical machine learning methods across a wide range of applications, from autonomous driving to medical…

Machine Learning · Computer Science 2025-07-29 Ziyi Liang , Annie Qu , Babak Shahbaba

Solving partial or ordinary differential equation models in cardiac electrophysiology is a computationally demanding task, particularly when high-resolution meshes are required to capture the complex dynamics of the heart. Moreover, in…

The integration of autonomous vehicles into urban traffic has great potential to improve efficiency by reducing congestion and optimizing traffic flow systematically. In this paper, we introduce CoMAL (Collaborative Multi-Agent LLMs), a…

Artificial Intelligence · Computer Science 2025-01-10 Huaiyuan Yao , Longchao Da , Vishnu Nandam , Justin Turnau , Zhiwei Liu , Linsey Pang , Hua Wei

Recent advances in scientific machine learning have shed light on the modeling of pattern-forming systems. However, simulations of real patterns still incur significant computational costs, which could be alleviated by leveraging large…

Computational Engineering, Finance, and Science · Computer Science 2023-02-28 Wei Li , Martin Z. Bazant , Juner Zhu

Learning dynamical systems through operator-theoretic representations provides a powerful framework for analyzing complex dynamics, as spectral quantities such as eigenvalues and invariant structures encode characteristic time scales and…

Machine Learning · Statistics 2026-05-19 Thibaut Germain , Sami Chemlal , Rémi Flamary , Vladimir R. Kostic , Karim Lounici

Surgical Scene Graphs abstract the complexity of surgical operating rooms (OR) into a structure of entities and their relations, but existing paradigms suffer from strictly dyadic structural limitations. Frameworks that predominantly rely…

Computer Vision and Pattern Recognition · Computer Science 2026-03-11 Tony Danjun Wang , Ka Young Kim , Tolga Birdal , Nassir Navab , Lennart Bastian

We propose neural network operator inference (NN-OpInf): a structure-preserving, composable, and minimally restrictive operator inference framework for the non-intrusive reduced-order modeling of dynamical systems. The approach learns…

Machine Learning · Computer Science 2026-03-10 Eric Parish , Anthony Gruber , Patrick Blonigan , Irina Tezaur

We present a neural-symbolic framework for observing the environment and continuously learning visual semantics and intuitive physics to reproduce them in an interactive simulation. The framework consists of five parts, a neural-symbolic…

Computer Vision and Pattern Recognition · Computer Science 2020-08-07 Michael Kissner

Transformer-based neural operators have emerged as promising surrogate solvers for partial differential equations, by leveraging the effectiveness of Transformers for capturing long-range dependencies and global correlations, profoundly…

Machine Learning · Computer Science 2025-08-07 Fangzhi Fei , Jiaxin Hu , Qiaofeng Li , Zhenyu Liu

The behavior of materials is influenced by a wide range of phenomena occurring across various time and length scales. To better understand the impact of microstructure on macroscopic response, multiscale modeling strategies are essential.…

Accurate and efficient solutions of spatiotemporal partial differential equations (PDEs), such as phase-field models, are fundamental for understanding interfacial dynamics and microstructural evolution in materials science and fluid…

Computational Physics · Physics 2026-02-19 Mostafa Bamdad , Mohammad Sadegh Eshaghi , Cosmin Anitescu , Navid Valizadeh , Timon Rabczuk

Geological carbon sequestration (GCS) involves injecting CO$_2$ into subsurface geological formations for permanent storage. Numerical simulations could guide decisions in GCS projects by predicting CO$_2$ migration pathways and the…

Machine Learning · Computer Science 2024-09-26 Jonathan E. Lee , Min Zhu , Ziqiao Xi , Kun Wang , Yanhua O. Yuan , Lu Lu