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Deep generative models such as diffusion and flow matching are powerful machine learning tools capable of learning and sampling from high-dimensional distributions. They are particularly useful when the training data appears to be…

High Energy Physics - Phenomenology · Physics 2026-04-30 Zachary Bogorad , Ibrahim Elsharkawy , Yonatan Kahn , Andrew J. Larkoski , Noam Levi

The inverse design of metasurfaces faces inherent challenges due to the nonlinear and highly complex relationship between geometric configurations and their electromagnetic behavior. Traditional optimization approaches often suffer from…

While the manifold hypothesis is widely adopted in modern machine learning, complex data is often better modeled as stratified spaces -- unions of manifolds (strata) of varying dimensions. Stratified learning is challenging due to varying…

Machine Learning · Statistics 2026-04-14 Randy Martinez , Rong Tang , Lizhen Lin

Generative models show great promise for the inverse design of molecules and inorganic crystals, but remain largely ineffective within more complex structures such as amorphous materials. Here, we present a diffusion model that reliably…

Disordered Systems and Neural Networks · Physics 2026-01-21 Kai Yang , Daniel Schwalbe-Koda

Topological phases feature robust edge states that are protected against the effects of defects and disorder. The robustness of these states presents opportunities to design technologies that are tolerant to fabrication errors and resilient…

Using group theoretic and topological concepts, together with tunneling phenomena, we geometrically design interfacial wave networks that contain splitters which partition energy in 2, 3, 4 or 5 directions. This enriches the valleytronics…

Mesoscale and Nanoscale Physics · Physics 2018-12-19 Mehul Makwana , Richard Craster

Inverse design, where we seek to design input variables in order to optimize an underlying objective function, is an important problem that arises across fields such as mechanical engineering to aerospace engineering. Inverse design is…

Machine Learning · Computer Science 2024-03-12 Tailin Wu , Takashi Maruyama , Long Wei , Tao Zhang , Yilun Du , Gianluca Iaccarino , Jure Leskovec

With recent advances in both responsive materials and fabrication techniques it is now possible to construct integrated functional structures, composed of both structural and active materials. We investigate the robust design of such…

Optimization and Control · Mathematics 2021-07-20 Andrew Akerson , Blaise Bourdin , Kaushik Bhattacharya

This study presents a generative optimization framework that builds on a fine-tuned diffusion model and reward-directed sampling to generate high-performance engineering designs. The framework adopts a parametric representation of the…

Machine Learning · Computer Science 2025-08-05 Hadi Keramati , Patrick Kirchen , Mohammed Hannan , Rajeev K. Jaiman

This paper presents a novel paradigm in simulation-based engineering sciences by introducing a new framework called Generative Parametric Design (GPD). The GPD framework enables the generation of new designs along with their corresponding…

Computational Engineering, Finance, and Science · Computer Science 2025-12-15 Mohammed El Fallaki Idrissi , Jad Mounayer , Sebastian Rodriguez , Fodil Meraghni , Francisco Chinesta

This study investigates human-computer interface generation based on diffusion models to overcome the limitations of traditional template-based design and fixed rule-driven methods. It first analyzes the key challenges of interface…

Human-Computer Interaction · Computer Science 2026-01-13 Rui Liu , Liuqingqing Yang , Runsheng Zhang , Shixiao Wang

Graph generation generally aims to create new graphs that closely align with a specific graph distribution. Existing works often implicitly capture this distribution through the optimization of generators, potentially overlooking the…

Machine Learning · Computer Science 2024-07-19 Song Wang , Zhen Tan , Xinyu Zhao , Tianlong Chen , Huan Liu , Jundong Li

Direct B-Rep generation is increasingly important in CAD workflows, eliminating costly modeling sequence data and supporting complex features. A key challenge is modeling joint distribution of the misaligned geometry and topology. Existing…

Computer Vision and Pattern Recognition · Computer Science 2025-07-08 Weilin Lai , Tie Xu , Hu Wang

2D topological insulators promise novel approaches towards electronic, spintronic, and quantum device applications. This is owing to unique features of their electronic band structure, in which bulk-boundary correspondences enforces the…

In this work, we explore the idea that effective generative models for point clouds under the autoencoding framework must acknowledge the relationship between a continuous surface, a discretized mesh, and a set of points sampled from the…

Machine Learning · Computer Science 2019-12-10 Austin Dill , Chun-Liang Li , Songwei Ge , Eunsu Kang

We propose a neural network-based computational framework for the simultaneous optimization of structural topology, curved layers, and path orientations to achieve strong anisotropic strength in fiber-reinforced thermoplastic composites…

Machine Learning · Computer Science 2025-05-08 Tao Liu , Tianyu Zhang , Yongxue Chen , Weiming Wang , Yu Jiang , Yuming Huang , Charlie C. L. Wang

Accurate early congestion prediction can prevent unpleasant surprises at the routing stage, playing a crucial character in assisting designers to iterate faster in VLSI design cycles. In this paper, we introduce a novel strategy to fully…

Machine Learning · Computer Science 2023-06-14 Yuxiang Zhao , Zhuomin Chai , Yibo Lin , Runsheng Wang , Ru Huang

Materials discovery is fundamental to advance next-generation technologies as well as for sustainable and circular economy. Beyond computational screening, generative models are efficient at finding materials with desired properties, via…

Generating trajectory data is among promising solutions to addressing privacy concerns, collection costs, and proprietary restrictions usually associated with human mobility analyses. However, existing trajectory generation methods are…

Machine Learning · Computer Science 2024-04-25 Yuanshao Zhu , James Jianqiao Yu , Xiangyu Zhao , Qidong Liu , Yongchao Ye , Wei Chen , Zijian Zhang , Xuetao Wei , Yuxuan Liang

We here introduce a novel scheme for generating smoothly-varying infill graded microstructural (IGM) configurations from a given menu of generating cells. The scheme was originally proposed for essentially improving the variety of…

Computational Engineering, Finance, and Science · Computer Science 2020-05-20 Dingchuan Xue , Yichao Zhu , Xu Guo