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Related papers: TorchGDM: A GPU-Accelerated Python Toolkit for Mul…

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pyGDM is a python toolkit for electro-dynamical simulations of individual nano-structures, based on the Green Dyadic Method (GDM). pyGDM uses the concept of a generalized propagator, which allows to solve cost-efficiently monochromatic…

pyGDM is a python toolkit for electro-dynamical simulations in nano-optics based on the Green Dyadic Method (GDM). In contrast to most other coupled-dipole codes, pyGDM uses a generalized propagator, which allows to cost-efficiently solve…

Computational Physics · Physics 2020-01-28 Peter R. Wiecha

Despite advances in scalable models, the inference tools used for Gaussian processes (GPs) have yet to fully capitalize on developments in computing hardware. We present an efficient and general approach to GP inference based on Blackbox…

Machine Learning · Computer Science 2021-07-01 Jacob R. Gardner , Geoff Pleiss , David Bindel , Kilian Q. Weinberger , Andrew Gordon Wilson

TorchOptics is an open-source Python library for differentiable Fourier optics simulations, developed using PyTorch to enable GPU-accelerated tensor computations and automatic differentiation. It provides a comprehensive framework for…

Optics · Physics 2024-11-28 Matthew J. Filipovich , A. I. Lvovsky

We propose PyTorchGeoNodes, a differentiable module for reconstructing 3D objects and their parameters from images using interpretable shape programs. Unlike traditional CAD model retrieval, shape programs allow reasoning about semantic…

Computer Vision and Pattern Recognition · Computer Science 2025-04-07 Sinisa Stekovic , Arslan Artykov , Stefan Ainetter , Mattia D'Urso , Friedrich Fraundorfer

Gradient-based algorithms are crucial to modern computer-vision and graphics applications, enabling learning-based optimization and inverse problems. For example, photorealistic differentiable rendering pipelines for color images have been…

Computer Vision and Pattern Recognition · Computer Science 2021-08-10 Benjamin Planche , Rajat Vikram Singh

magnum.np is a micromagnetic finite-difference library completely based on the tensor library PyTorch. The use of such a high level library leads to a highly maintainable and extensible code base which is the ideal candidate for the…

Computational Physics · Physics 2023-02-20 Florian Bruckner , Sabri Koraltan , Claas Abert , Dieter Suess

Light scattering by spherical-shaped particles of sizes comparable to the wavelength is foundational in many areas of science, from chemistry to atmospheric science, photonics and nanotechnology. With the new capabilities offered by machine…

We present a GPU-accelerated numerical approach for fast kernel and differential background solutions. The model image proposed in the Bramich (2008) difference image analysis algorithm is analogous to a very simple Convolutional Neural…

Instrumentation and Methods for Astrophysics · Physics 2021-05-04 James A. Hitchcock , Markus Hundertmark , Daniel Foreman-Mackey , Etienne Bachelet , Martin Dominik , Rachel Street , Yiannis Tsapras

Continuous-depth learning has recently emerged as a novel perspective on deep learning, improving performance in tasks related to dynamical systems and density estimation. Core to these approaches is the neural differential equation, whose…

Machine Learning · Computer Science 2020-09-22 Michael Poli , Stefano Massaroli , Atsushi Yamashita , Hajime Asama , Jinkyoo Park

Solving partial differential equations (PDEs) on fine spatio-temporal scales for high-fidelity solutions is critical for numerous scientific breakthroughs. Yet, this process can be prohibitively expensive, owing to the inherent complexities…

Numerical Analysis · Mathematics 2024-04-09 Yulong Lu , Wuzhe Xu

Large-scale molecular dynamics simulations with high accuracy have been increasingly popular for their capability to bridge the gap between atomistic modeling and mesoscale phenomena. Both machine learning potentials and enhanced sampling…

Computational Physics · Physics 2026-03-24 Haoting Zhang , Qiuhan Jia , Zhennan Zhang , Yijie Zhu , Zhongwei Zhang , Junjie Wang , Jiuyang Shi , Zheyong Fan , Jian Sun

Efficient methods for generating samples of wave packet trajectories are needed to build machine learning models for quantum dynamics. However, simulating such data by direct integration of the time-dependent Schrodinger equation can be…

Materials Science · Physics 2024-01-17 Rei Nagaya , Haruki Omatsu , Daniel M. Packwood

This work introduces CTorch, a PyTorch-compatible, GPU-accelerated, and auto-differentiable projector toolbox designed to handle various CT geometries with configurable projector algorithms. CTorch provides flexible scanner geometry…

Medical Physics · Physics 2025-12-15 Xiao Jiang , Grace J. Gang , J. Webster Stayman

Modern graphics processing units (GPUs) provide an unprecedented level of computing power. In this study, we present a high-performance, multi-GPU implementation of the analytical nuclear gradient for Kohn-Sham time-dependent density…

While beam search improves speech recognition quality over greedy decoding, standard implementations are slow, often sequential, and CPU-bound. To fully leverage modern hardware capabilities, we present a novel open-source FlexCTC toolkit…

Audio and Speech Processing · Electrical Eng. & Systems 2025-08-14 Lilit Grigoryan , Vladimir Bataev , Nikolay Karpov , Andrei Andrusenko , Vitaly Lavrukhin , Boris Ginsburg

This paper introduces a novel CUDA-enabled PyTorch-based framework designed for the gradient-based optimization of such reconfigurable electromagnetic structures with electrically tunable parameters. Traditional optimization techniques for…

Computational Physics · Physics 2025-11-25 Johannes Müller , Dennis Philipp , Matthias Günther

Through the Non-Equilibrium Green's Function (NEGF) formalism, quantum-scale device simulation can be performed with the inclusion of electron-phonon scattering. However, the simulation of realistically sized devices under the NEGF…

Mesoscale and Nanoscale Physics · Physics 2015-05-27 Stephen Cauley , Mathieu Luisier , Venkataramanan Balakrishnan , Gerhard Klimeck , Cheng-Kok Koh

While 3D Gaussian Splatting (3DGS) has revolutionized photorealistic rendering, its vast ecosystem of assets remains incompatible with high-performance LiDAR simulation, a critical tool for robotics and autonomous driving. We present…

Robotics · Computer Science 2025-09-23 Junzhe Wu , Yufei Jia , Yiyi Yan , Zhixing Chen , Tiao Tan , Zifan Wang , Guangyu Wang

Despite the success of deep learning in computer vision and natural language processing, Gradient Boosted Decision Tree (GBDT) is yet one of the most powerful tools for applications with tabular data such as e-commerce and FinTech. However,…

Machine Learning · Computer Science 2022-01-25 ZhenZhe Ying , Zhuoer Xu , Zhifeng Li , Weiqiang Wang , Changhua Meng
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