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Although reproducibility is a core tenet of the scientific method, it remains challenging to reproduce many results. Surprisingly, this also holds true for computational results in domains such as systems biology where there have been…

Quantitative Methods · Quantitative Biology 2021-04-13 Michael L. Blinov , John H. Gennari , Jonathan R. Karr , Ion I. Moraru , David P. Nickerson , Herbert M. Sauro

This paper represents preliminary work in identifying the foundation for the discipline of Software Engineering and discovering the links between the domains of Software Engineering and Information Technology (IT). Our research utilized…

Software Engineering · Computer Science 2022-10-28 Jones Yeboah , Feifei Pang , Hari Priya Ponnakanti

Circuit compilation, a crucial process for adapting quantum algorithms to hardware constraints, often operates as a ``black box,'' with limited visibility into the optimization techniques used by proprietary systems or advanced open-source…

Quantum Physics · Physics 2025-04-29 Satwik Kundu , Swaroop Ghosh

Scientific software projects evolve rapidly in their initial development phase, yet at the end of a funding period, the completion of a research project, thesis, or publication, further engagement in the project may slow down or cease…

General Literature · Computer Science 2021-05-10 Jörg Fehr , Christian Himpe , Stephan Rave , Jens Saak

Context: Jupyter Notebook has emerged as a versatile tool that transforms how researchers, developers, and data scientists conduct and communicate their work. As the adoption of Jupyter notebooks continues to rise, so does the interest from…

Software Engineering · Computer Science 2026-01-06 Md Saeed Siddik , Hao Li , Cor-Paul Bezemer

Software architecture often consists of interconnected components dispersed across source code and other development artifacts, making visualization difficult without costly additional documentation. Although some tools can automatically…

Software Engineering · Computer Science 2024-07-26 Filipe F. Correia , Ricardo Ferreira , Paulo G. G Queiroz , Henrique Nunes , Matilde Barra , Duarte Figueiredo

Scientific code is not production software. Scientific code participates in the evaluation of a scientific hypothesis. This imposes specific constraints on the code that are often overlooked in practice. We articulate, with a small example,…

General Literature · Computer Science 2019-04-25 Fabien Benureau , Nicolas Rougier

Reverse engineering tools remain monolithic and imperative compared to the advancement of modern compiler architectures: analyses are tied to a single mutable representation, making them difficult to extend or refine, and forcing premature…

Programming Languages · Computer Science 2026-03-31 Chang Liu , Yihao Sun , Thomas Gilray , Kristopher Micinski

The reproducibility of scientific findings are an important hallmark of quality and integrity in research. The scientific method requires hypotheses to be subjected to the most crucial tests, and for the results to be consistent across…

Computers and Society · Computer Science 2019-09-11 Dustin Tanksley , Donald C. Wunsch

Context: Refactoring is the art of modifying the design of a system without altering its behavior. The idea is to reorganize variables, classes and methods to facilitate their future adaptations and comprehension. As the concept of behavior…

Software Engineering · Computer Science 2021-07-23 Eman Abdullah AlOmar , Mohamed Wiem Mkaouer , Christian Newman , Ali Ouni

Refactoring is a change made to the internal structure of software to make it easier to understand and cheaper to modify without changing its observable behaviour. A database refactoring is a small change to the database schema which…

Software Engineering · Computer Science 2010-09-09 Patrick O'Beirne

While many good textbooks are available on Protein Structure, Molecular Simulations, Thermodynamics and Bioinformatics methods in general, there is no good introductory level book for the field of Structural Bioinformatics. This book aims…

Biomolecules · Quantitative Biology 2023-07-10 K. Anton Feenstra , Sanne Abeln

Background: Assessing and communicating software engineering research can be challenging. Design science is recognized as an appropriate research paradigm for applied research but is seldom referred to in software engineering. Applying the…

Software Engineering · Computer Science 2020-07-01 Emelie Engström , Margaret-Anne Storey , Per Runeson , Martin Höst , Maria Teresa Baldassarre

In an effort to overcome the data deluge in computational biology and bioinformatics and to facilitate bioinformatics research in the era of big data, we identify some of the most influential algorithms that have been widely used in the…

Distributed, Parallel, and Cluster Computing · Computer Science 2017-10-03 Faraz Faghri , Sayed Hadi Hashemi , Mohammad Babaeizadeh , Mike A. Nalls , Saurabh Sinha , Roy H. Campbell

Biophysics is a subject that is spread over many disciplines and transcends the skills and knowledge of the individual student. This makes it challenging both to teach and to learn. Educational materials are described to aid in teaching…

Physics Education · Physics 2015-06-15 J. M. Deutsch

Building Performance Simulation (BPS) uses advanced computational and data science methods. Reproducibility, the ability to obtain the same results by using the same data and methods, is essential in BPS research to ensure the reliability…

Digital Libraries · Computer Science 2025-03-19 Christian Ghiaus

Refactoring is the de-facto practice to optimize software health. While several studies propose refactoring strategies to optimize software design through applying design patterns and removing design defects, little is known about how…

Software Engineering · Computer Science 2021-11-16 Eman Abdullah AlOmar , Tianjia Wang , Vaibhavi Raut , Mohamed Wiem Mkaouer , Christian Newman , Ali Ouni

Research has become increasingly reliant on software, serving as the driving force behind bioinformatics, high performance computing, physics, machine learning and artificial intelligence, to name a few. While substantial progress has been…

Software Engineering · Computer Science 2024-05-30 Vanessa Sochat

Artificial Intelligence (AI) faces persistent challenges in terms of transparency and accountability, which requires rigorous documentation. Through a literature review on documentation practices, we provide an overview of prevailing…

Digital Libraries · Computer Science 2024-06-28 Stefan Arnold , Dilara Yesilbas , Rene Gröbner , Dominik Riedelbauch , Maik Horn , Sven Weinzierl

Software re-modularization is an old preoccupation of reverse engineering research. The advantages of a well structured or modularized system are well known. Yet after so much time and efforts, the field seems unable to come up with…

Software Engineering · Computer Science 2012-10-29 Nicolas Anquetil , Jannik Laval