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We describe MGARD, a software providing MultiGrid Adaptive Reduction for floating-point scientific data on structured and unstructured grids. With exceptional data compression capability and precise error control, MGARD addresses a wide…

In this paper we focus on the integration of high-performance numerical libraries in ab initio codes and the portability of performance and scalability. The target of our work is FLEUR, a software for electronic structure calculations…

Computational Engineering, Finance, and Science · Computer Science 2016-11-03 Diego Fabregat-Traver , Davor Davidović , Markus Höhnerbach , Edoardo Di Napoli

Fortran's prominence in scientific computing requires strategies to ensure both that legacy codes are efficient on high-performance computing systems, and that the language remains attractive for the development of new high-performance…

Instrumentation and Methods for Astrophysics · Physics 2024-09-13 James McKevitt , Eduard I. Vorobyov , Igor Kulikov

Efficient code retrieval is critical for developer productivity, yet existing benchmarks largely focus on Python and rarely stress-test robustness beyond superficial lexical cues. To address the gap, we introduce an automated pipeline for…

Software Engineering · Computer Science 2026-03-06 Kaicheng Wang , Liyan Huang , Weike Fang , Weihang Wang

MLPACK is a state-of-the-art, scalable, multi-platform C++ machine learning library released in late 2011 offering both a simple, consistent API accessible to novice users and high performance and flexibility to expert users by leveraging…

Mathematical Software · Computer Science 2021-06-24 Ryan R. Curtin , James R. Cline , N. P. Slagle , William B. March , Parikshit Ram , Nishant A. Mehta , Alexander G. Gray

Acceleration of cryptographic applications on massively parallel computing platforms, such as Graphics Processing Units (GPUs), becomes a real challenge as their decreasing cost and mass production makes practical implementations…

Cryptography and Security · Computer Science 2013-05-17 Jean-Marie Chauvet , Eric Mahé

Derivative computation is a key component of optimization, sensitivity analysis, uncertainty quantification, and nonlinear solvers. Automatic differentiation (AD) is a powerful technique for evaluating such derivatives, and in recent years,…

Mathematical Software · Computer Science 2025-07-18 Kim Liegeois , Brian Kelley , Eric Phipps , Sivasankaran Rajamanickam , Vassil Vassilev

We present GURLS, a least squares, modular, easy-to-extend software library for efficient supervised learning. GURLS is targeted to machine learning practitioners, as well as non-specialists. It offers a number state-of-the-art training…

Machine Learning · Computer Science 2013-03-06 Andrea Tacchetti , Pavan K Mallapragada , Matteo Santoro , Lorenzo Rosasco

RUMD is a general purpose, high-performance molecular dynamics (MD) simulation package running on graphical processing units (GPU's). RUMD addresses the challenge of utilizing the many-core nature of modern GPU hardware when simulating…

Guessing random additive noise decoding (GRAND) is a recently proposed decoding paradigm particularly suitable for codes with short length and high rate. Among its variants, ordered reliability bits GRAND (ORBGRAND) exploits soft…

Information Theory · Computer Science 2024-04-30 Li Wan , Wenyi Zhang

Graphics Processing Units (GPU) offer tremendous computational power by following a throughput oriented computing paradigm where many thousand computational units operate in parallel. Programming this massively parallel hardware is…

Programming Languages · Computer Science 2023-05-08 Bastian Köpcke , Sergei Gorlatch , Michel Steuwer

The multi-resolution approximation (MRA) of Gaussian processes was recently proposed to conduct likelihood-based inference for massive spatial data sets. An advantage of the methodology is that it can be parallelized. We implemented the MRA…

Computation · Statistics 2019-05-07 Huang Huang , Lewis R. Blake , Dorit M. Hammerling

The present panorama of HPC architectures is extremely heterogeneous, ranging from traditional multi-core CPU processors, supporting a wide class of applications but delivering moderate computing performance, to many-core GPUs, exploiting…

We propose a platform-independent multi-threaded function library that provides data structures to generate, differentiate and render both the ordinary basis and the normalized B-basis of a user-specified extended Chebyshev (EC) space that…

Mathematical Software · Computer Science 2018-10-16 Ágoston Róth

Computational reproducibility, the possibility for independent researchers to exactly reproduce published empirical results, is fundamental to science. Despite its importance, the proportion of research articles aiming for reproducibility…

Modern applications are driving demand for ultra-reliable low-latency communications, rekindling interest in the performance of short, high-rate error correcting codes. To that end, here we introduce a soft-detection variant of Guessing…

Information Theory · Computer Science 2021-06-16 Ken R. Duffy

On the way to Exascale, programmers face the increasing challenge of having to support multiple hardware architectures from the same code base. At the same time, portability of code and performance are increasingly difficult to achieve as…

Distributed, Parallel, and Cluster Computing · Computer Science 2022-06-14 Thomas Heller , Hartmut Kaiser , Patrick Diehl , Dietmar Fey , Marc Alexander Schweitzer

SOL is an open-source library for scalable online learning algorithms, and is particularly suitable for learning with high-dimensional data. The library provides a family of regular and sparse online learning algorithms for large-scale…

Machine Learning · Computer Science 2016-10-31 Yue Wu , Steven C. H. Hoi , Chenghao Liu , Jing Lu , Doyen Sahoo , Nenghai Yu

Adapting large, object-oriented C++ codebases for hardware acceleration might be extremely challenging, particularly when targeting heterogeneous platforms such as GPUs. Marionette is a C++17 library designed to address this by enabling…

Distributed, Parallel, and Cluster Computing · Computer Science 2025-11-10 Nuno dos Santos Fernandes , Pedro Tomás , Nuno Roma , Frank Winklmeier , Patricia Conde-Muíño

We present MGPU, a C++ programming library targeted at single-node multi-GPU systems. Such systems combine disproportionate floating point performance with high data locality and are thus well suited to implement real-time algorithms. We…

Distributed, Parallel, and Cluster Computing · Computer Science 2015-03-03 Sebastian Schaetz , Martin Uecker
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