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Coverage analysis is widely used but can suffer from high overhead. This overhead is especially acute in the context of Python, which is already notoriously slow (a recent study observes a roughly 30x slowdown vs. native code). We find that…

Software Engineering · Computer Science 2023-06-01 Juan Altmayer Pizzorno , Emery D Berger

We present MXtalTools, a flexible Python package for the data-driven modelling of molecular crystals, facilitating machine learning studies of the molecular solid state. MXtalTools comprises several classes of utilities: (1) synthesis,…

Machine Learning · Computer Science 2025-11-26 Michael Kilgour , Mark E. Tuckerman , Jutta Rogal

Compendium Manager is a command-line tool written in Python to automate the provisioning, launch, and evaluation of bioinformatics pipelines. Although workflow management tools such as Snakemake and Nextflow enable users to automate the…

Genomics · Quantitative Biology 2025-05-19 Richard J. Abdill , Ran Blekhman

Developing efficient parallel applications is critical to advancing scientific development but requires significant performance analysis and optimization. Performance analysis tools help developers manage the increasing complexity and scale…

Distributed, Parallel, and Cluster Computing · Computer Science 2024-01-25 Onur Cankur , Aditya Tomar , Daniel Nichols , Connor Scully-Allison , Katherine E. Isaacs , Abhinav Bhatele

Software verification is an important tool in establishing the reliability of critical systems. One potential area of application is in the field of robotics, as robots take on more tasks in both day-to-day areas and highly specialised…

Robotics · Computer Science 2022-07-21 Dara MacConville , Marie Farrell , Matt Luckcuck , Rosemary Monahan

The study of research trends is pivotal for understanding scientific development on specific topics. Traditionally, this involves keyword analysis within scholarly literature, yet comprehensive tools for such analysis are scarce, especially…

Digital Libraries · Computer Science 2024-03-28 Zhenyuan Lu , Wei Li , Burcu Ozek , Haozhou Zhou , Srinivasan Radhakrishnan , Sagar Kamarthi

Graph representations of programs are commonly a central element of machine learning for code research. We introduce an open source Python library python_graphs that applies static analysis to construct graph representations of Python…

Machine Learning · Computer Science 2022-08-17 David Bieber , Kensen Shi , Petros Maniatis , Charles Sutton , Vincent Hellendoorn , Daniel Johnson , Daniel Tarlow

This paper describes the design and implementation of Stingray, a library in Python built to perform time series analysis and related tasks on astronomical light curves. Its core functionality comprises a range of Fourier analysis…

Instrumentation and Methods for Astrophysics · Physics 2019-08-12 D. Huppenkothen , M. Bachetti , A. L. Stevens , S. Migliari , P. Balm , O. Hammad , U. M. Khan , H. Mishra , H. Rashid , S. Sharma , R. V. Blanco , E. M. Ribeiro

This paper presents a lightweight, open-source and high-performance python package for solving peridynamics problems in solid mechanics. The development of this solver is motivated by the need for fast analysis tools to achieve the large…

Software Engineering · Computer Science 2021-09-15 B. Boys , T. J. Dodwell , M. Hobbs , M. Girolami

Behavioral studies using personal digital devices typically produce rich longitudinal datasets of mixed data types. These data provide information about the behavior of users of these devices in real-time and in the users' natural…

Human-Computer Interaction · Computer Science 2022-12-06 A. Ikäheimonen , A. M. Triana , N. Luong , A. Ziaei , J. Rantaharju , R. Darst , T. Aledavood

The amazing advances being made in the fields of machine and deep learning are a highlight of the Big Data era for both enterprise and research communities. Modern applications require resources beyond a single node's ability to provide.…

Performance analysis is a critical step in the oft-repeated, iterative process of performance tuning of parallel programs. Per-process, per-thread traces (detailed logs of events with timestamps) enable in-depth analysis of parallel program…

Distributed, Parallel, and Cluster Computing · Computer Science 2024-05-15 Abhinav Bhatele , Rakrish Dhakal , Alexander Movsesyan , Aditya K. Ranjan , Onur Cankur

SpeechPy is an open source Python package that contains speech preprocessing techniques, speech features, and important post-processing operations. It provides most frequent used speech features including MFCCs and filterbank energies…

Sound · Computer Science 2018-07-25 Amirsina Torfi

The increasing availability of high-quality optical and near-infrared spectroscopic data, as well as advances in modelling techniques, have greatly expanded the scientific potential of spectroscopic studies. However, the software tools…

Instrumentation and Methods for Astrophysics · Physics 2025-12-23 Daniele Gasparri , Lorenzo Morelli , Umberto Battino , Jairo Méndez Abreu , Adriana de Lorenzo-Cáceres

Misconceptions about program execution hinder many novice programmers. We introduce SimpliPy, a notional machine designed around a carefully chosen Python subset to clarify core control flow and scoping concepts. Its foundation is a precise…

Programming Languages · Computer Science 2025-10-21 Moida Praneeth Jain , Venkatesh Choppella

QuTiP, the Quantum Toolbox in Python, has been at the forefront of open-source quantum software for the past 13 years. It is used as a research, teaching, and industrial tool, and has been downloaded millions of times by users around the…

This paper describes the autofeat Python library, which provides scikit-learn style linear regression and classification models with automated feature engineering and selection capabilities. Complex non-linear machine learning models, such…

Machine Learning · Computer Science 2020-02-27 Franziska Horn , Robert Pack , Michael Rieger

1. Natural sounds have been recorded for millions of hours over the previous decades using passive acoustic monitoring. Improvements in deep learning models have vastly accelerated the analysis of large portions of this data. While new…

Machine Learning · Computer Science 2026-04-14 Vincent S. Kather , Sylvain Haupert , Burooj Ghani , Dan Stowell

Software that processes real-world data or that models a physical system must have some way of managing units. While simple approaches like the understood convention that all data are in a unit system (such as the MKS SI unit system) do…

Instrumentation and Methods for Astrophysics · Physics 2018-10-03 Nathan J. Goldbaum , John A. ZuHone , Matthew J. Turk , Kacper Kowalik , Anna L. Rosen

Plyades: A Python Library for Space Mission Design Designing a space mission is a computation-heavy task. Software tools that conduct the necessary numerical simulations and optimizations are therefore indispensable. The usability of…

Instrumentation and Methods for Astrophysics · Physics 2016-07-05 Helge Eichhorn , Reiner Anderl
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