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Learning expressive representations for high-dimensional yet sparse features has been a longstanding problem in information retrieval. Though recent deep learning methods can partially solve the problem, they often fail to handle the…

We present Mechanistic PDE Networks -- a model for discovery of governing partial differential equations from data. Mechanistic PDE Networks represent spatiotemporal data as space-time dependent linear partial differential equations in…

机器学习 · 计算机科学 2025-06-12 Adeel Pervez , Efstratios Gavves , Francesco Locatello

Drug discovery is a complex, resource-intensive process requiring significant time and cost to bring new medicines to patients. Many generative models aim to accelerate drug discovery, but few produce synthetically accessible molecules.…

机器学习 · 计算机科学 2025-01-30 Zygimantas Jocys , Zhanxing Zhu , Henriette M. G. Willems , Katayoun Farrahi

Deep learning has demonstrated its strengths in numerous binary analysis tasks, including function boundary detection, binary code search, function prototype inference, value set analysis, etc. When applying deep learning to binary analysis…

机器学习 · 计算机科学 2021-09-15 Xuezixiang Li , Qu Yu , Heng Yin

The limited availability of high-quality training data poses a major obstacle in data-driven PDE solving, where expensive data collection and resolution constraints severely impact the ability of neural operator networks to learn and…

机器学习 · 计算机科学 2025-10-29 Xihang Yue , Yi Yang , Linchao Zhu

Conventional visualization tools such as phase diagrams and convex hulls are ill-suited to visualize multiple principal element alloys (MPEAs) due to their large compositional space that cannot be easily projected onto two dimensions. Here,…

材料科学 · 物理学 2025-07-17 John Cavin , Pravan Omprakash , Adrien Couet , Rohan Mishra

Accuracy in neural PDE solvers often breaks down not because of limited expressivity, but due to poor optimisation caused by ill-conditioning, especially in multi-fidelity and stiff problems. We study this issue in Physics-Informed Extreme…

机器学习 · 计算机科学 2025-08-11 Siddharth Rout

Efficient and stable solution of partial differential equations (PDEs) is central to scientific and engineering applications, yet existing numerical solvers rely heavily on matrix based discretizations, while learning based methods require…

机器学习 · 计算机科学 2026-04-30 Yi Bing , Zheng Ran , Fu Jinyang , Liu Long , Peng Xiang

The use of composable abstractions allows the application of new and established algorithms to a wide range of problems while automatically inheriting the benefits of well-known performance optimisations. This work highlights the…

数学软件 · 计算机科学 2016-11-01 Michael Lange , Lawrence Mitchell , Matthew G. Knepley , Gerard J. Gorman

Recently deep reinforcement learning has achieved tremendous success in wide ranges of applications. However, it notoriously lacks data-efficiency and interpretability. Data-efficiency is important as interacting with the environment is…

机器学习 · 计算机科学 2021-06-23 Duo Xu , Faramarz Fekri

Learning the full family of solutions to parameterized partial differential equations (PDEs) is a central challenge to our ability to model the behavior of heterogeneous systems, with a variety of fundamental and application-oriented…

计算物理 · 物理学 2026-01-26 Milad Panahi , Giovanni Michele Porta , Monica Riva , Alberto Guadagnini

Identifying governing equations for a dynamical system is a topic of critical interest across an array of disciplines, from mathematics to engineering to biology. Machine learning -- specifically deep learning -- techniques have shown their…

动力系统 · 数学 2026-05-07 Nibodh Boddupalli , Timothy Matchen , Jeff Moehlis

Partial differential equations (PDEs) govern nearly every physical process in science and engineering, yet solving them at scale remains prohibitively expensive. Generative AI has transformed language, vision, and protein science, but…

机器学习 · 计算机科学 2026-04-10 Yilong Dai , Shengyu Chen , Xiaowei Jia , Runlong Yu

Symbolic execution is a powerful systematic software analysis technique, but suffers from the high cost of constraint solving, which is the key supporting technology that affects the effectiveness of symbolic execution. Techniques like…

软件工程 · 计算机科学 2020-03-19 Junye Wen , Mujahid Khan , Meiru Che , Yan Yan , Guowei Yang

While Large Language Models (LLMs) provide semantic flexibility for robotic task planning, their susceptibility to hallucination and logical inconsistency limits their reliability in long-horizon domains. To bridge the gap between…

人工智能 · 计算机科学 2026-03-26 Keru Hua , Ding Wang , Yaoying Gu , Xiaoguang Ma

Neuro-symbolic NLP methods aim to leverage the complementary strengths of large language models and formal logical solvers. However, current approaches are mostly static in nature, i.e., the integration of a target solver is predetermined…

计算与语言 · 计算机科学 2025-10-09 Lei Xu , Pierre Beckmann , Marco Valentino , André Freitas

Symbolic indefinite integration in Computer Algebra Systems such as Maple involves selecting the most effective algorithm from multiple available methods. Not all methods will succeed for a given problem, and when several do, the results,…

符号计算 · 计算机科学 2025-08-11 Rashid Barket , Matthew England , Jürgen Gerhard

Implicit shape representation, such as SDFs, is a popular approach to recover the surface of a 3D shape as the level sets of a scalar field. Several methods approximate SDFs using machine learning strategies that exploit the knowledge that…

计算机视觉与模式识别 · 计算机科学 2026-02-13 Diego Patiño , Knut Peterson , Kostas Daniilidis , David K. Han

We present a Transformer-based framework for Constraint Satisfaction Problems (CSPs). CSPs find use in many applications and thus accelerating their solution with machine learning is of wide interest. Most existing approaches rely on…

机器学习 · 计算机科学 2025-06-11 Yudong W. Xu , Wenhao Li , Scott Sanner , Elias B. Khalil

In computer vision, depth estimation is crucial for domains like robotics, autonomous vehicles, augmented reality, and virtual reality. Integrating semantics with depth enhances scene understanding through reciprocal information sharing.…

计算机视觉与模式识别 · 计算机科学 2023-08-29 Md Awsafur Rahman , Shaikh Anowarul Fattah