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Finding a software engineering approach that allows for portability, rapid development, and open collaboration for high-performance computing on GPUs and CPUs is a challenge. We implement a portability scheme using the Numba compiler for…

Computational Physics · Physics 2025-05-30 Joanna Piper Morgan , Ilham Variansyah , Braxton Cuneo , Todd S. Palmer , Kyle E. Niemeyer

A graph-inspired classifier, known as Optimum-Path Forest (OPF), has proven to be a state-of-the-art algorithm comparable to Logistic Regressors, Support Vector Machines in a wide variety of tasks. Recently, its Python-based version,…

Machine Learning · Computer Science 2021-06-23 Gustavo H. de Rosa , João Paulo Papa

Currently, Python is one of the most widely used languages in various application areas. However, it has limitations when it comes to optimizing and parallelizing applications due to the nature of its official CPython interpreter,…

Distributed, Parallel, and Cluster Computing · Computer Science 2022-05-24 Andrés Milla , Enzo Rucci

Despite advancements in the areas of parallel and distributed computing, the complexity of programming on High Performance Computing (HPC) resources has deterred many domain experts, especially in the areas of machine learning and…

Transformers are the driving force behind today's Large Language Models (LLMs), serving as the foundation for their performance and versatility. Yet, their compute and memory costs grow with sequence length, posing scalability challenges…

With the evolution of large language models, traditional Transformer models become computationally demanding for lengthy sequences due to the quadratic growth in computation with respect to the sequence length. Mamba, emerging as a…

Machine Learning · Computer Science 2024-08-22 Haoran Xu , Ziqian Liu , Rong Fu , Zhongling Su , Zerui Wang , Zheng Cai , Zhilin Pei , Xingcheng Zhang

Effective reasoning is crucial to solving complex mathematical problems. Recent large language models (LLMs) have boosted performance by scaling test-time computation through long chain-of-thought reasoning. However, transformer-based…

Machine Learning · Computer Science 2025-09-10 Junxiong Wang , Wen-Ding Li , Daniele Paliotta , Daniel Ritter , Alexander M. Rush , Tri Dao

The numba-mpi package offers access to the Message Passing Interface (MPI) routines from Python code that uses the Numba just-in-time (JIT) compiler. As a result, high-performance and multi-threaded Python code may utilize MPI communication…

Distributed, Parallel, and Cluster Computing · Computer Science 2024-10-08 Kacper Derlatka , Maciej Manna , Oleksii Bulenok , David Zwicker , Sylwester Arabas

Python currently is the dominant language in the field of Machine Learning but is often criticized for being slow to perform certain tasks. In this report, we use the well-known $N$-queens puzzle as a benchmark to show that once compiled…

Mathematical Software · Computer Science 2020-01-14 Pascal Fua , Krzysztof Lis

Synthesizing Mixed-Boolean Arithmetic (MBA) expressions from input-output examples is central to program deobfuscation and also useful for compiler optimization, reverse engineering, and cryptanalysis. Existing MBA synthesizers are…

Programming Languages · Computer Science 2026-05-12 Gabriel Bathie , Baptiste Mouillon , Nathanaël Fijalkow

State space models (SSMs) like Mamba have recently attracted much attention. Compared to Transformer-based large language models (LLMs), Mamba achieves linear computation complexity with the sequence length and demonstrates superior…

Computation and Language · Computer Science 2025-10-13 Renjie Wei , Songqiang Xu , Linfeng Zhong , Zebin Yang , Qingyu Guo , Yuan Wang , Runsheng Wang , Meng Li

This paper reports the development of a Python Non-Uniform Fast Fourier Transform (PyNUFFT) package, which accelerates non-Cartesian image reconstruction on heterogeneous platforms. Scientific computing with Python encompasses a mature and…

Medical Physics · Physics 2017-10-10 Jyh-Miin Lin

Linear RNN architectures, like Mamba, can be competitive with Transformer models in language modeling while having advantageous deployment characteristics. Given the focus on training large-scale Transformer models, we consider the…

Machine Learning · Computer Science 2025-06-30 Junxiong Wang , Daniele Paliotta , Avner May , Alexander M. Rush , Tri Dao

Fast Multipole Methods (FMM) are a fundamental operation for the simulation of many physical problems. The high performance design of such methods usually requires to carefully tune the algorithm for both the targeted physics and the…

Distributed, Parallel, and Cluster Computing · Computer Science 2012-06-04 Emmanuel Agullo , Béranger Bramas , Olivier Coulaud , Eric Darve , Matthias Messner , Takahashi Toru

The rise of GPU-based high-performance computing (HPC) has driven the widespread adoption of parallel programming models such as CUDA. Yet, the inherent complexity of parallel programming creates a demand for the automated…

Software Engineering · Computer Science 2025-10-23 Changxin Ke , Rui Zhang , Shuo Wang , Li Ding , Guangli Li , Yuanbo Wen , Shuoming Zhang , Ruiyuan Xu , Jin Qin , Jiaming Guo , Chenxi Wang , Ling Li , Qi Guo , Yunji Chen

State-Space Models (SSMs) have emerged as efficient alternatives to transformers for sequential data tasks, offering linear or near-linear scalability with sequence length, making them ideal for long-sequence applications in NLP, vision,…

Machine Learning · Computer Science 2025-04-01 Arghadip Das , Arnab Raha , Shamik Kundu , Soumendu Kumar Ghosh , Deepak Mathaikutty , Vijay Raghunathan

We have developed a Python package ZMCintegral for multi-dimensional Monte Carlo integration on multiple Graphics Processing Units(GPUs). The package employs a stratified sampling and heuristic tree search algorithm. We have built three…

Computational Physics · Physics 2022-09-19 Hong-Zhong Wu , Jun-Jie Zhang , Long-Gang Pang , Qun Wang

We introduce jaxFMM, an open-source, adaptive, highly parallel point-charge Fast Multipole Method implementation for the Laplace kernel written in JAX. It is based on a non-uniform refinement strategy, which results in extremely concise and…

Computational Physics · Physics 2025-11-20 Robert Kraft , Florian Bruckner , Dieter Suess , Claas Abert

exa-AMD is a Python-based application designed to accelerate the discovery and design of functional materials by integrating AI/ML tools, materials databases, and quantum mechanical calculations into scalable, high-performance workflows.…

Distributed, Parallel, and Cluster Computing · Computer Science 2025-06-27 Maxim Moraru , Weiyi Xia , Zhuo Ye , Feng Zhang , Yongxin Yao , Ying Wai Li , Cai-Zhuang Wang

Parallel processing is considered as todays and future trend for improving performance of computers. Computing devices ranging from small embedded systems to big clusters of computers rely on parallelizing applications to reduce execution…

Distributed, Parallel, and Cluster Computing · Computer Science 2014-11-27 Oussama Tahan
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