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In this work, we present {\ae}net-PyTorch, a PyTorch-based implementation for training artificial neural network-based machine learning interatomic potentials. Developed as an extension of the atomic energy network ({\ae}net),…

Disordered Systems and Neural Networks · Physics 2023-05-10 Jon Lopez-Zorrilla , Xabier M. Aretxabaleta , Inwon Yue , Inigo Etxebarria , Hegoi Manzano , Nongnuch Artrith

Climate change has resulted in a year over year increase in adverse weather and weather conditions which contribute to increasingly severe fire seasons. Without effective mitigation, these fires pose a threat to life, property, ecology,…

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

Machine learning has emerged as a powerful solution to the modern challenges in accelerator physics. However, the limited availability of beam time, the computational cost of simulations, and the high-dimensionality of optimisation problems…

Accelerator Physics · Physics 2024-05-30 Jan Kaiser , Chenran Xu , Annika Eichler , Andrea Santamaria Garcia

We introduce nvTorchCam, an open-source library under the Apache 2.0 license, designed to make deep learning algorithms camera model-independent. nvTorchCam abstracts critical camera operations such as projection and unprojection, allowing…

Computer Vision and Pattern Recognition · Computer Science 2024-10-17 Daniel Lichy , Hang Su , Abhishek Badki , Jan Kautz , Orazio Gallo

Forest fires pose a natural threat with devastating social, environmental, and economic implications. The rapid and highly uncertain rate of spread of wildfires necessitates a trustworthy digital tool capable of providing real-time…

Wildfires are becoming more frequent and their effects more devastating every day. Climate change has directly and indirectly affected the occurrence of these, as well as social phenomena have increased the vulnerability of people.…

Computer Vision and Pattern Recognition · Computer Science 2023-01-13 Eldan R. Daniel

In this work, we introduce DeepFlame, an open-source C++ platform with the capabilities of utilising machine learning algorithms and pre-trained models to solve for reactive flows. We combine the individual strengths of the computational…

Fluid Dynamics · Physics 2023-07-17 Runze Mao , Minqi Lin , Yan Zhang , Tianhan Zhang , Zhi-Qin John Xu , Zhi X. Chen

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

The increasing incidence and severity of wildfires underscores the necessity of accurately predicting their behavior. While high-fidelity models derived from first principles offer physical accuracy, they are too computationally expensive…

Machine Learning · Computer Science 2022-11-01 John Burge , Matthew R. Bonanni , R. Lily Hu , Matthias Ihme

The $\texttt{torch-choice}$ is an open-source library for flexible, fast choice modeling with Python and PyTorch. $\texttt{torch-choice}$ provides a $\texttt{ChoiceDataset}$ data structure to manage databases flexibly and…

Machine Learning · Computer Science 2025-06-05 Tianyu Du , Ayush Kanodia , Susan Athey

We present "torchGDM", a numerical framework for nano-optical simulations based on the Green's Dyadic Method (GDM). This toolkit combines a hybrid approach, allowing for both fully discretized nano-structures and structures approximated by…

Wildfires represent one of the most relevant natural disasters worldwide, due to their impact on various societal and environmental levels. Thus, a significant amount of research has been carried out to investigate and apply computer vision…

We present a new open source python package, based on PyLightcurve and PyTorch, tailored for efficient computation and automatic differentiation of exoplanetary transits. The classes and functions implemented are fully vectorised, natively…

Earth and Planetary Astrophysics · Physics 2021-03-24 Mario Morvan , Angelos Tsiaras , Nikolaos Nikolaou , Ingo P. Waldmann

Forecasting bushfire spread is an important element in fire prevention and response efforts. Empirical observations of bushfire spread can be used to estimate fire response under certain conditions. These observations form rate-of-spread…

Machine Learning · Computer Science 2022-03-24 Andrew Bolt , Joel Janek Dabrowski , Carolyn Huston , Petra Kuhnert

Maximizing performance on available GPU hardware is an ongoing challenge for modern AI inference systems. Traditional approaches include writing custom GPU kernels and using specialized model compilers to tune high-level code for specific…

Multiagent Systems · Computer Science 2026-05-15 Kirill Nagaitsev , Luka Grbcic , Samuel Williams , Costin Iancu

Early wildfire detection in remote and forest areas is crucial for minimizing devastation and preserving ecosystems. Autonomous drones offer agile access to remote, challenging terrains, equipped with advanced imaging technology that…

Computer Vision and Pattern Recognition · Computer Science 2024-01-17 Austin Briley , Fatemeh Afghah

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

The PySCF package has emerged as a powerful and flexible open-source platform for quantum chemistry simulations. However, the efficiency of electronic structure calculations can vary significantly depending on the choice of computational…

Chemical Physics · Physics 2025-06-10 Zhichen Pu , Qiming Sun

Wildland fires are complex multi-physics problems that span wide spatial scale ranges. Capturing this complexity in computationally affordable numerical simulations for process studies and "outer-loop" techniques (e.g., optimization and…