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In standard neural network training, the gradients in the backward pass are determined by the forward pass. As a result, the two stages are coupled. This is how most neural networks are trained currently. However, gradient modification in…

Machine Learning · Computer Science 2022-09-21 Bishshoy Das , Milton Mondal , Brejesh Lall , Shiv Dutt Joshi , Sumantra Dutta Roy

Adversarial training, especially projected gradient descent (PGD), has proven to be a successful approach for improving robustness against adversarial attacks. After adversarial training, gradients of models with respect to their inputs…

Machine Learning · Statistics 2023-04-21 Ricardo Bigolin Lanfredi , Joyce D. Schroeder , Tolga Tasdizen

We have designed a polarization-splitting grating coupler (PSGC) in silicon-oninsulator (SOI) that has 1.2 dB peak loss in numerical simulations, which is the best simulated performance of PSGCs without a bottom reflector to the best of our…

Optics · Physics 2023-02-08 Peng Sun , Thomas Van Vaerenbergh , Sean Hooten , Raymond Beausoleil

While bigger and deeper neural network architectures continue to advance the state-of-the-art for many computer vision tasks, real-world adoption of these networks is impeded by hardware and speed constraints. Conventional model compression…

Machine Learning · Computer Science 2017-12-19 Anubhav Ashok , Nicholas Rhinehart , Fares Beainy , Kris M. Kitani

Designing free-form photonic devices is fundamentally challenging due to the vast number of possible geometries and the complex requirements of fabrication constraints. Traditional inverse-design approaches--whether driven by human…

Optics · Physics 2025-04-25 Dongjin Seo , Soobin Um , Sangbin Lee , Jong Chul Ye , Haejun Chung

High-performance concrete requires complex mix design decisions involving interdependent variables and practical constraints. While data-driven methods have improved predictive modeling for forward design in concrete engineering, inverse…

Machine Learning · Computer Science 2025-12-11 Agung Nugraha , Heungjun Im , Jihwan Lee

Gradient-based inverse design in photonics has already achieved remarkable results in designing small-footprint, high-performance optical devices. The adjoint variable method, which allows for the efficient computation of gradients, has…

Reinforcement learning has shown promise in learning policies that can solve complex problems. However, manually specifying a good reward function can be difficult, especially for intricate tasks. Inverse reinforcement learning offers a…

Machine Learning · Computer Science 2017-11-28 Peter Henderson , Wei-Di Chang , Pierre-Luc Bacon , David Meger , Joelle Pineau , Doina Precup

Recently, machine learning has been introduced in the inverse design of physical devices, i.e., the automatic generation of device geometries for a desired physical response. In particular, generative adversarial networks have been proposed…

Optics · Physics 2025-02-18 Timo Gahlmann , Philippe Tassin

Designing physical artifacts that serve a purpose - such as tools and other functional structures - is central to engineering as well as everyday human behavior. Though automating design has tremendous promise, general-purpose methods do…

Probabilistic circuit (PC) structure learning is hampered by greedy algorithms that make irreversible, locally optimal decisions. We propose SymCircuit, which replaces greedy search with a learned generative policy trained via…

Machine Learning · Computer Science 2026-03-24 Y. Sungtaek Ju

Policy gradient methods are among the most effective methods for large-scale reinforcement learning, and their empirical success has prompted several works that develop the foundation of their global convergence theory. However, prior works…

Machine Learning · Computer Science 2020-12-25 Junzi Zhang , Jongho Kim , Brendan O'Donoghue , Stephen Boyd

We introduce a new method for inverse design of nanophotonic devices which guarantees that resulting designs satisfy strict length scale constraints - including minimum width and spacing constraints required by commercial semiconductor…

Emerging Technologies · Computer Science 2022-07-26 Martin F. Schubert , Alfred K. C. Cheung , Ian A. D. Williamson , Aleksandra Spyra , David H. Alexander

The generation of radiation from free electrons passing a grating, known as Smith-Purcell radiation, finds various applications including non-destructive beam diagnostics and tunable light sources, ranging from terahertz towards X-rays. So…

Optics · Physics 2022-01-25 Urs Haeusler , Michael Seidling , Peyman Yousefi , Peter Hommelhoff

Inverse design of optical components based on adjoint sensitivity analysis has the potential to address the most challenging photonic engineering problems. However existing inverse design tools based on finite-difference-time-domain (FDTD)…

Optics · Physics 2024-05-20 Dodd Gray , Gavin N. West , Rajeev J. Ram

We present a mathematical framework and computational methods to optimally design a finite number of sequential experiments. We formulate this sequential optimal experimental design (sOED) problem as a finite-horizon partially observable…

Machine Learning · Computer Science 2024-03-28 Wanggang Shen , Xun Huan

A major challenge in the pharmaceutical industry is to design novel molecules with specific desired properties, especially when the property evaluation is costly. Here, we propose MNCE-RL, a graph convolutional policy network for molecular…

Machine Learning · Computer Science 2020-11-17 Chencheng Xu , Qiao Liu , Minlie Huang , Tao Jiang

Sequential Bayesian optimal experimental design (SBOED) for PDE-governed inverse problems is computationally challenging, especially for infinite-dimensional random field parameters. High-fidelity approaches require repeated forward and…

Optimization and Control · Mathematics 2026-01-12 Kaichen Shen , Peng Chen

The inverse mapping of GANs'(Generative Adversarial Nets) generator has a great potential value.Hence, some works have been developed to construct the inverse function of generator by directly learning or adversarial learning.While the…

Machine Learning · Computer Science 2017-09-13 Junyu Luo , Yong Xu , Chenwei Tang , Jiancheng Lv

We propose a novel approach to model viscoelasticity materials using neural networks, which capture rate-dependent and nonlinear constitutive relations. However, inputs and outputs of the neural networks are not directly observable, and…

Numerical Analysis · Mathematics 2020-05-12 Kailai Xu , Alexandre M. Tartakovsky , Jeff Burghardt , Eric Darve