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Many science advances have been possible thanks to the use of research software, which has become essential to advancing virtually every Science, Technology, Engineering and Mathematics (STEM) discipline and many non-STEM disciplines…

Software Engineering · Computer Science 2019-02-26 Daniel S. Katz , Patrick Aerts , Neil P. Chue Hong , Anshu Dubey , Sandra Gesing , Henry J. Neeman , David E. Pearah

High Performance Computing (HPC), Artificial Intelligence (AI)/Machine Learning (ML), and Quantum Computing (QC) and communications offer immense opportunities for innovation and impact on society. Researchers in these areas depend on…

Computers and Society · Computer Science 2020-12-18 William Gropp , Sujata Banerjee , Ian Foster

The increasing heterogeneity of high-performance computing (HPC) systems and the transition to exascale architectures require systematic and reproducible performance evaluation across diverse workloads. While continuous integration (CI)…

Distributed, Parallel, and Cluster Computing · Computer Science 2026-03-24 Jayesh Badwaik , Mathis Bode , Michal Rajski , Andreas Herten

The transformations, analyses and interpretations of data in scientific workflows are vital for the repeatability and reliability of scientific workflows. This provenance of scientific workflows has been effectively carried out in Grid…

Databases · Computer Science 2016-11-18 Khawar Hasham , Kamran Munir , Jetendr Shamdasani , Richard McClatchey

The advent of experimental science facilities-instruments and observatories, such as the Large Hadron Collider, the Laser Interferometer Gravitational Wave Observatory, and the upcoming Large Synoptic Survey Telescope-has brought about…

Distributed, Parallel, and Cluster Computing · Computer Science 2019-02-12 E. A. Huerta , Roland Haas , Shantenu Jha , Mark Neubauer , Daniel S. Katz

For scientific software, especially those used for large-scale simulations, achieving good performance and efficiently using the available hardware resources is essential. It is important to regularly perform benchmarks to ensure the…

For large-scale scientific simulations, it is expensive to store raw simulation results to perform post-analysis. To minimize expensive I/O, "in-situ" analysis is often used, where analysis applications are tightly coupled with scientific…

Distributed, Parallel, and Cluster Computing · Computer Science 2020-12-01 Feng Li , Dali Wang , Feng Yan , Fengguang Song

In cancer research, clustering techniques are widely used for exploratory analyses and dimensionality reduction, playing a critical role in the identification of novel cancer subtypes, often with direct implications for patient management.…

At large scales, quantum systems may become advantageous over their classical counterparts at performing certain tasks. Developing tools to analyse these systems at the relevant scales, in a manner consistent with quantum mechanics, is…

Quantum Physics · Physics 2024-11-12 Timon Schapeler , Robert Schade , Michael Lass , Christian Plessl , Tim J. Bartley

Considerable scientific work involves locating, analyzing, systematizing, and synthesizing other publications. Its results end up in a paper's "background" section or in standalone articles, which include meta-analyses and systematic…

Digital Libraries · Computer Science 2023-12-05 Diomidis Spinellis

High intensive computation applications can usually take days to months to finish an execution. During this time, it is common to have variations of the available resources when considering that such hardware is usually shared among a…

Distributed, Parallel, and Cluster Computing · Computer Science 2015-01-27 Kiran Mantripragada , Alecio Binotto , Leonardo P. Tizzei

Recent studies have shown that the majority of published computational models in systems biology and physiology are not repeatable or reproducible. There are a variety of reasons for this. One of the most likely reasons is that given how…

Other Quantitative Biology · Quantitative Biology 2021-07-13 Herbert M. Sauro

Reproducibility should be a cornerstone of scientific research and is a growing concern among the scientific community and the public. Understanding how to design services and tools that support documentation, preservation and sharing is…

Human-Computer Interaction · Computer Science 2019-03-15 Sebastian S. Feger , Sünje Dallmeier-Tiessen , Albrecht Schmidt , Paweł W. Woźniak

The escalating complexity of applications and services encourages a shift towards higher-level data processing pipelines that integrate both Cloud-native and HPC steps into the same workflow. Cloud providers and HPC centers typically…

Distributed, Parallel, and Cluster Computing · Computer Science 2024-09-26 Antony Chazapis , Evangelos Maliaroudakis , Fotis Nikolaidis , Manolis Marazakis , Angelos Bilas

Replication of scientific experiments is critical to the advance of science. Unfortunately, the discipline of Computer Science has never treated replication seriously, even though computers are very good at doing the same thing over and…

General Literature · Computer Science 2013-04-15 Ian P. Gent

This work introduces a companion reproducible paper with the aim of allowing the exact replication of the methods, experiments, and results discussed in a previous work [5]. In that parent paper, we proposed many and varied techniques for…

Data Structures and Algorithms · Computer Science 2019-12-30 Antonio Fariña , Miguel A. Martínez-Prieto , Francisco Claude , Gonzalo Navarro , Juan J. Lastra-Díaz , Nicola Prezza , Diego Seco

Hardware support for high-performance computing (HPC) has so far been subject to significant advances. The pervasiveness of HPC systems, mainly made up with parallel computing units, makes it crucial to spread and vivify effective HPC…

Distributed, Parallel, and Cluster Computing · Computer Science 2018-02-06 Claude Tadonki

Independent computational reproducibility of scientific results is rapidly becoming of pivotal importance in scientific progress as computation itself plays a more and more central role in so many branches of science. Historically,…

Quantitative Methods · Quantitative Biology 2016-08-25 Les Hatton , Gregory Warr

The rise of AI and the economic dominance of cloud computing have created a new nexus of innovation for high performance computing (HPC), which has a long history of driving scientific discovery. In addition to performance needs, scientific…

Distributed, Parallel, and Cluster Computing · Computer Science 2025-06-10 Vanessa Sochat , Daniel Milroy , Abhik Sarkar , Aniruddha Marathe , Tapasya Patki
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