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Many areas of science and engineering encounter data defined on spherical manifolds. Modelling and analysis of spherical data often necessitates spherical harmonic transforms, at high degrees, and increasingly requires efficient computation…

Computational Physics · Physics 2025-06-19 Matthew A. Price , Jason D. McEwen

Value iteration can find the optimal replenishment policy for a perishable inventory problem, but is computationally demanding due to the large state spaces that are required to represent the age profile of stock. The parallel processing…

Artificial Intelligence · Computer Science 2025-04-07 Joseph Farrington , Kezhi Li , Wai Keong Wong , Martin Utley

We present msmJAX, a Python package implementing the multilevel summation method with B-spline interpolation, a linear-scaling algorithm for efficiently evaluating electrostatic and other long-range interactions in particle-based…

Computational Physics · Physics 2025-10-08 Florian Buchner , Johannes Schörghuber , Nico Unglert , Jesús Carrete , Georg K. H. Madsen

We demonstrate a GPU-accelerated nested sampling framework for efficient high-dimensional Bayesian inference in cosmology. Using JAX-based neural emulators and likelihoods for cosmic microwave background and cosmic shear analyses, our…

Cosmology and Nongalactic Astrophysics · Physics 2025-10-08 Toby Lovick , David Yallup , Davide Piras , Alessio Spurio Mancini , Will Handley

We present Rieoptax, an open source Python library for Riemannian optimization in JAX. We show that many differential geometric primitives, such as Riemannian exponential and logarithm maps, are usually faster in Rieoptax than existing…

Optimization and Control · Mathematics 2022-10-11 Saiteja Utpala , Andi Han , Pratik Jawanpuria , Bamdev Mishra

We present Synkhronos, an extension to Theano for multi-GPU computations leveraging data parallelism. Our framework provides automated execution and synchronization across devices, allowing users to continue to write serial programs without…

Distributed, Parallel, and Cluster Computing · Computer Science 2017-10-13 Adam Stooke , Pieter Abbeel

Multiplex tissue immunostaining is a technology of growing relevance as it can capture in situ the complex interactions existing between the elements of the tumor microenvironment. The existence and availability of large, annotated image…

Computer Vision and Pattern Recognition · Computer Science 2021-03-09 Daniel Jiménez-Sánchez , Mikel Ariz , Carlos Ortiz-de-Solórzano

While most robotics simulation libraries are built for low-dimensional and intrinsically serial tasks, soft-body and multi-agent robotics have created a demand for simulation environments that can model many interacting bodies in parallel.…

Robotics · Computer Science 2019-11-26 Jacob Austin , Rafael Corrales-Fatou , Sofia Wyetzner , Hod Lipson

Traditional neuromorphic hardware architectures rely on event-driven computation, where the asynchronous transmission of events, such as spikes, triggers local computations within synapses and neurons. While machine learning frameworks are…

Neural and Evolutionary Computing · Computer Science 2024-01-31 Eric Müller , Moritz Althaus , Elias Arnold , Philipp Spilger , Christian Pehle , Johannes Schemmel

We present KinetiX, a software toolkit to generate computationally efficient fuel-specific routines for the chemical source term, thermodynamic and mixture-averaged transport properties for use in combustion simulation codes. The C++…

Computational Physics · Physics 2025-02-25 Bogdan A. Danciu , Christos E. Frouzakis

Numerical simulations are ubiquitous in mathematics and computational science. Several industrial and clinical applications entail modeling complex multiphysics systems that evolve over a variety of spatial and temporal scales. This study…

Mathematical Software · Computer Science 2022-11-14 Pasquale Claudio Africa

Molecular simulations are an important tool for research in physics, chemistry, and biology. The capabilities of simulations can be greatly expanded by providing access to advanced sampling methods and techniques that permit calculation of…

We present Brax, an open source library for rigid body simulation with a focus on performance and parallelism on accelerators, written in JAX. We present results on a suite of tasks inspired by the existing reinforcement learning…

Robotics · Computer Science 2021-06-28 C. Daniel Freeman , Erik Frey , Anton Raichuk , Sertan Girgin , Igor Mordatch , Olivier Bachem

Characterizing the temporal variability of astrophysical sources is key to understanding the underlying physical processes driving their emissions. This work introduces a gammapy_SyLC, a Python package that offers tools to simulate and fit…

High Energy Astrophysical Phenomena · Physics 2025-03-19 Claudio Galelli

Modern imaging instruments can produce terabytes to petabytes of data for a single experiment. The biggest barrier to processing big image datasets has been computational, where image analysis algorithms often lack the efficiency needed to…

Computer Vision and Pattern Recognition · Computer Science 2026-03-13 Nicholas Schaub , Andriy Kharchenko , Hamdah Abbasi , Sameeul Samee , Hythem Sidky , Nathan Hotaling

Optimization time integrators are effective at solving complex multi-physics problems including deformable solids with non-linear material models, contact with friction, strain limiting, etc. For challenging problems, Newton-type optimizers…

Computational Engineering, Finance, and Science · Computer Science 2026-01-01 José Antonio Fernández-Fernández , Fabian Löschner , Lukas Westhofen , Andreas Longva , Jan Bender

The formation of the large-scale structure, the evolution and distribution of galaxies, quasars, and dark matter on cosmological scales, requires numerical simulations. Differentiable simulations provide gradients of the cosmological…

Instrumentation and Methods for Astrophysics · Physics 2022-11-21 Yin Li , Libin Lu , Chirag Modi , Drew Jamieson , Yucheng Zhang , Yu Feng , Wenda Zhou , Ngai Pok Kwan , François Lanusse , Leslie Greengard

GROMACS is a widely-used molecular dynamics software package with a focus on performance, portability, and maintainability across a broad range of platforms. Thanks to its early algorithmic redesign and flexible heterogeneous…

Distributed, Parallel, and Cluster Computing · Computer Science 2025-09-26 Andrey Alekseenko , Szilárd Páll , Erik Lindahl

Bayesian parameter inference for complex stochastic simulators is challenging due to intractable likelihood functions. Existing simulation-based inference methods often require large number of simulations and become costly to use in…

Machine Learning · Computer Science 2026-04-06 Vasilis Gkolemis , Christos Diou , Michael U. Gutmann

We introduce fastabx, a high-performance Python library for building ABX discrimination tasks. ABX is a measure of the separation between generic categories of interest. It has been used extensively to evaluate phonetic discriminability in…

Computation and Language · Computer Science 2025-05-06 Maxime Poli , Emmanuel Chemla , Emmanuel Dupoux