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Gradient-based meta-learning methods have primarily been applied to classical machine learning tasks such as image classification. Recently, PDE-solving deep learning methods, such as neural operators, are starting to make an important…

Machine Learning · Computer Science 2023-02-06 Lu Zhang , Huaiqian You , Tian Gao , Mo Yu , Chung-Hao Lee , Yue Yu

Recently, Mixture-of-Experts (short as MoE) architecture has achieved remarkable success in increasing the model capacity of large-scale language models. However, MoE requires incorporating significantly more parameters than the base model…

Computation and Language · Computer Science 2022-10-14 Ze-Feng Gao , Peiyu Liu , Wayne Xin Zhao , Zhong-Yi Lu , Ji-Rong Wen

Deep generative models and neural operators have demonstrated significant potential for 3D aerodynamic inference. However, they often face inherent challenges in maintaining physical consistency and preserving high-frequency features,…

Numerical Analysis · Mathematics 2026-04-28 Ruiling Jiang , Yong Zhang , Houbiao Li

Sparse Mixture-of-Experts (MoE) models offer a powerful way to scale model size without increasing compute, as per-token FLOPs depend only on k active experts rather than the total pool of E experts. Yet, this asymmetry creates an MoE…

Machine Learning · Computer Science 2026-05-15 Linghao Jin , Chufan Shi , Huijuan Wang , Nuan Wen , Zhengzhong Liu , Eric Xing , Xuezhe Ma

Recent advances in generative models, particularly diffusion and auto-regressive models, have revolutionized fields like computer vision and natural language processing. However, their application to structure-based drug design (SBDD)…

Machine Learning · Computer Science 2025-07-29 Yi He , Ailun Wang , Zhi Wang , Yu Liu , Xingyuan Xu , Wen Yan

We propose a new class of physics-informed neural networks, called Physics-Informed Generator-Encoder Adversarial Networks, to effectively address the challenges posed by forward, inverse, and mixed problems in stochastic differential…

Machine Learning · Computer Science 2023-11-06 Ruisong Gao , Min Yang , Jin Zhang

We propose the geometry-informed neural operator (GINO), a highly efficient approach to learning the solution operator of large-scale partial differential equations with varying geometries. GINO uses a signed distance function and…

We present the partial evolutionary tensor neural networks (pETNNs), a novel framework for solving time-dependent partial differential equations with high accuracy and capable of handling high-dimensional problems. Our architecture…

Numerical Analysis · Mathematics 2025-12-08 Tunan Kao , He Zhang , Lei Zhang , Jin Zhao

Neural operators have emerged as a powerful data-driven paradigm for solving partial differential equations (PDEs), while their accuracy and scalability are still limited, particularly on irregular domains where fluid flows exhibit rich…

Machine Learning · Computer Science 2026-02-26 Qinxuan Wang , Chuang Wang , Mingyu Zhang , Jingwei Sun , Peipei Yang , Shuo Tang , Shiming Xiang

Deep generative models have proven useful for automatic design synthesis and design space exploration. However, they face three challenges when applied to engineering design: 1) generated designs lack diversity, 2) it is difficult to…

Machine Learning · Computer Science 2020-07-10 Wei Chen , Faez Ahmed

Current neural operators often struggle to generalize to complex, out-of-distribution conditions, limiting their ability in seismic wavefield representation. To address this, we propose a generative neural operator (GNO) that leverages…

Geophysics · Physics 2025-03-11 Shijun Cheng , Mohammad H. Taufik , Tariq Alkhalifah

Inverse design, which seeks to find optimal parameters for a target output, is a central challenge in engineering. Surrogate-based optimization (SBO) has become a standard approach, yet it is fundamentally structured to converge to a…

Machine Learning · Computer Science 2025-10-08 Muhammad Arif Hakimi Zamrai

Diffusion models, emerging as powerful deep generative tools, excel in various applications. They operate through a two-steps process: introducing noise into training samples and then employing a model to convert random noise into new…

Computer Vision and Pattern Recognition · Computer Science 2026-02-13 Huijie Zhang , Yifu Lu , Ismail Alkhouri , Saiprasad Ravishankar , Dogyoon Song , Qing Qu

Optimal control problems with nonsmooth objectives and nonlinear partial differential equation (PDE) constraints are challenging, mainly because of the underlying nonsmooth and nonconvex structures and the demanding computational cost for…

Optimization and Control · Mathematics 2025-04-25 Yongcun Song , Xiaoming Yuan , Hangrui Yue , Tianyou Zeng

Current performance-driven building design methods are not widely adopted outside the research field for several reasons that make them difficult to integrate into a typical design process. In the early design phase, in particular, the…

Machine Learning · Computer Science 2022-04-19 Spyridon Ampanavos , Ali Malkawi

Neural operator surrogates for time-dependent partial differential equations (PDEs) conventionally employ autoregressive prediction schemes, which accumulate error over long rollouts and require uniform temporal discretization. We introduce…

Machine Learning · Computer Science 2025-12-08 Xianglong Hou , Xinquan Huang , Paris Perdikaris

Pretraining on large-scale collections of PDE-governed spatiotemporal trajectories has recently shown promise for building generalizable models of dynamical systems. Yet most existing PDE foundation models rely on deterministic Transformer…

Machine Learning · Computer Science 2026-04-21 Zituo Chen , Sili Deng

Diffusion models (DMs) represent state-of-the-art generative models for continuous inputs. DMs work by constructing a Stochastic Differential Equation (SDE) in the input space (ie, position space), and using a neural network to reverse it.…

Machine Learning · Computer Science 2024-05-14 Tianrong Chen , Jiatao Gu , Laurent Dinh , Evangelos A. Theodorou , Joshua Susskind , Shuangfei Zhai

Recent advances in transformer-based text-to-motion generation have led to impressive progress in synthesizing high-quality human motion. Nevertheless, jointly achieving high fidelity, streaming capability, real-time responsiveness, and…

Computer Vision and Pattern Recognition · Computer Science 2026-05-05 Dongjie Fu , Tengjiao Sun , Pengcheng Fang , Xiaohao Cai , Hansung Kim

Memory complexity and data scarcity have so far prohibited learning solution operators of partial differential equations (PDEs) at high resolutions. We address these limitations by introducing a new data efficient and highly parallelizable…

Machine Learning · Computer Science 2023-10-03 Jean Kossaifi , Nikola Kovachki , Kamyar Azizzadenesheli , Anima Anandkumar