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As quantum computing advances from theoretical promise to experimental reality, the need for rigorous experiment tracking becomes critical. Drawing inspiration from best practices in machine learning (ML) and artificial intelligence (AI),…

Quantum Physics · Physics 2025-07-10 Mahee Gamage , Otso Kinanen , Jake Muff , Vlad Stirbu

The connect-fill-run workflow paradigm, widely adopted in mature software engineering, accelerates collaborative development. However, computational chemistry, computational materials science, and computational biology face persistent…

Chemical Physics · Physics 2025-08-12 Jianan Wang , Wenbo Guo , Xin Yue , Minjie Xu , Yueqiang Zheng , Jingxiang Dong , Jiarui Hu , Jian Xia , Chuixiong Wu

Quantum computing provides computational advantages in various domains. To benefit from these advantages complex hybrid quantum applications must be built, which comprise both quantum and classical programs. Engineering these applications…

When the IceCube experiment started serious software development it needed a development environment in which both its developers and clients could work and that would encourage and support a good software development process. Some of the…

Software Engineering · Computer Science 2007-05-23 S. Patton , D. Glowacki

[Context & Motivation] Adaptive systems are an important research area. The dominant reason for adaptivity in systems are changes in the environment. Thus, it is an important question how to model the environment and how to determine the…

Software Engineering · Computer Science 2020-11-17 Fabian Kneer , Erik Kamsties , Klaus Schmid

Understanding the earth's climate system and how it might be changing is a preeminent scientific challenge. Global climate models are used to simulate past, present, and future climates, and experiments are executed continuously on an array…

Complex system simulation has been playing an irreplaceable role in understanding, predicting, and controlling diverse complex systems. In the past few decades, the multi-scale simulation technique has drawn increasing attention for its…

Systems and Control · Electrical Eng. & Systems 2024-07-25 Huandong Wang , Huan Yan , Can Rong , Yuan Yuan , Fenyu Jiang , Zhenyu Han , Hongjie Sui , Depeng Jin , Yong Li

Quantum computing resources are among the most promising candidates for extending the computational capabilities of High-Performance Computing (HPC) systems. As a result, HPC-quantum integration has become an increasingly active area of…

Scientific computing can in some sense be distilled to the execution of an application - or rather sets of applications which are combined into complex workflows. Due to the complexity and number both of scientific packages as well as…

Distributed, Parallel, and Cluster Computing · Computer Science 2017-08-01 Bruce Becker , Sean Murray

The rapid evolution of embedded systems, along with the growing variety and complexity of AI algorithms, necessitates a powerful hardware/software co-design methodology based on virtual prototyping technologies. The market offers a diverse…

Distributed, Parallel, and Cluster Computing · Computer Science 2025-10-20 Tim Kraus , Axel Sauer , Ingo Feldner

Computing systems are omnipresent; their sustainability has become crucial for our society. A key aspect of this sustainability is the ability of computing systems to cope with the continuous change they face, ranging from dynamic operating…

Software Engineering · Computer Science 2022-04-15 Danny Weyns , Thomas Baeck , Rene Vidal , Xin Yao , Ahmed Nabil Belbachir

Software is the key crosscutting technology that enables advances in mathematics, computer science, and domain-specific science and engineering to achieve robust simulations and analysis for science, engineering, and other research fields.…

Process Execution Engines are a vital part of Business Process Management (BPM) and Manufacturing Orchestration Management (MOM), as they allow the business or manufacturing logic (expressed in a graphical notation such as BPMN) to be…

Other Computer Science · Computer Science 2022-09-20 Juergen Mangler , Stefanie Rinderle-Ma

The work described in this paper is a contribution to the problems of managing in data-intensive scientific applications. First, we discuss scientific workflows and motivate there use in scientific applications. Then, we introduce the…

Networking and Internet Architecture · Computer Science 2007-05-23 Khaled Gaaloul , François Charoy , Claude Godart

The evolving landscape of scientific computing requires seamless transitions from experimental to production HPC environments for interactive workflows. This paper presents a structured transition pathway developed at OLCF that bridges the…

Scientific workflows are becoming increasingly popular for compute-intensive and data-intensive scientific applications. The vision and promise of scientific workflows includes rapid, easy workflow design, reuse, scalable execution, and…

Databases · Computer Science 2013-11-26 Víctor Cuevas-Vicenttín , Saumen Dey , Sven Köhler , Sean Riddle , Bertram Ludäscher

Various Cloud layers have to work in concert in order to manage and deploy complex multi-cloud applications, executing sophisticated workflows for Cloud resource deployment, activation, adjustment, interaction, and monitoring. While there…

Distributed, Parallel, and Cluster Computing · Computer Science 2016-07-25 Mathias Slawik , Begüm İlke Zilci , Yuri Demchenko , José Ignacio Aznar Baranda , Robert Branchat , Charles Loomis , Oleg Lodygensky , Christophe Blanchet

CPU is undoubtedly the most important resource of the computer system. Recent advances in software and system architecture have increased processing complexity, as computing is now distributed and parallel. CloudSim represents the…

Distributed, Parallel, and Cluster Computing · Computer Science 2018-07-16 Arezoo Khatibi , Omid Khatibi

In this paper, we summarize our effort to create and utilize a simple framework to coordinate computational analytics tasks with the help of a workflow system. Our design is based on a minimalistic approach while at the same time allowing…

Distributed, Parallel, and Cluster Computing · Computer Science 2022-11-01 Gregor von Laszewski , J. P. Fleischer , Geoffrey C. Fox

Urban systems are intrinsically complex, involving different dimensions and scales, and consequently various approaches and scientific disciplines. In that context, urban simulation models have been coined as essential for the construction…

Computers and Society · Computer Science 2021-05-31 Juste Raimbault