Architectural Concept and Evaluation of a Framework for the Efficient Automation of Computational Scientific Workflows: An Energy Systems Analysis Example

Scientists and engineers involved in the design of complex system solutions use computational workflows for their evaluations. Along with growing system complexity, the complexity of these workflows also increases. Without integration tools, scientists and engineers are often highly concerned with h...

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Main Authors: Jianlei Liu, Eric Braun, Clemens Düpmeier, Patrick Kuckertz, D. Severin Ryberg, Martin Robinius, Detlef Stolten, Veit Hagenmeyer
Format: Article
Language:English
Published: MDPI AG 2019-02-01
Series:Applied Sciences
Subjects:
Online Access:https://www.mdpi.com/2076-3417/9/4/728
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author Jianlei Liu
Eric Braun
Clemens Düpmeier
Patrick Kuckertz
D. Severin Ryberg
Martin Robinius
Detlef Stolten
Veit Hagenmeyer
author_facet Jianlei Liu
Eric Braun
Clemens Düpmeier
Patrick Kuckertz
D. Severin Ryberg
Martin Robinius
Detlef Stolten
Veit Hagenmeyer
author_sort Jianlei Liu
collection DOAJ
description Scientists and engineers involved in the design of complex system solutions use computational workflows for their evaluations. Along with growing system complexity, the complexity of these workflows also increases. Without integration tools, scientists and engineers are often highly concerned with how to integrate software tools and model sets, which hinders their original research or engineering aims. Therefore, a new framework for streamlining the creation and usage of automated computational workflows is introduced in the present article. It uses state-of-the-art technologies for automation (e.g., container-automation) and coordination (e.g., distributed message oriented middleware), and a microservice-based architecture for novel distributed process execution and coordination. It also supports co-simulations as part of larger workflows including additional auxiliary computational tasks, e.g., forecasting or data transformation. Using Apache NiFi, an easy-to-use web interface is provided to create, run and control workflows without the need to be concerned with the underlying computing infrastructure. Initial framework testing via the implementation of a real-world workflow underpins promising performance in the realms of parallelizability, low overheads and reliable coordination.
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spelling doaj.art-e98ffa9d54c94493a3c0f8fe30c3d65a2022-12-22T01:12:31ZengMDPI AGApplied Sciences2076-34172019-02-019472810.3390/app9040728app9040728Architectural Concept and Evaluation of a Framework for the Efficient Automation of Computational Scientific Workflows: An Energy Systems Analysis ExampleJianlei Liu0Eric Braun1Clemens Düpmeier2Patrick Kuckertz3D. Severin Ryberg4Martin Robinius5Detlef Stolten6Veit Hagenmeyer7Institute for Automation and Applied Informatics (IAI), Karlsruhe Institute of Technology (KIT), Hermann-von-Helmholtz-Platz 1, 76344 Eggenstein-Leopoldshafen, GermanyInstitute for Automation and Applied Informatics (IAI), Karlsruhe Institute of Technology (KIT), Hermann-von-Helmholtz-Platz 1, 76344 Eggenstein-Leopoldshafen, GermanyInstitute for Automation and Applied Informatics (IAI), Karlsruhe Institute of Technology (KIT), Hermann-von-Helmholtz-Platz 1, 76344 Eggenstein-Leopoldshafen, GermanyInstitute of Electrochemical Process Engineering (IEK-3), Forschungszentrum Jülich GmbH, Wilhelm-Johnen-Straße, 52428 Jülich, GermanyInstitute of Electrochemical Process Engineering (IEK-3), Forschungszentrum Jülich GmbH, Wilhelm-Johnen-Straße, 52428 Jülich, GermanyInstitute of Electrochemical Process Engineering (IEK-3), Forschungszentrum Jülich GmbH, Wilhelm-Johnen-Straße, 52428 Jülich, GermanyInstitute of Electrochemical Process Engineering (IEK-3), Forschungszentrum Jülich GmbH, Wilhelm-Johnen-Straße, 52428 Jülich, GermanyInstitute for Automation and Applied Informatics (IAI), Karlsruhe Institute of Technology (KIT), Hermann-von-Helmholtz-Platz 1, 76344 Eggenstein-Leopoldshafen, GermanyScientists and engineers involved in the design of complex system solutions use computational workflows for their evaluations. Along with growing system complexity, the complexity of these workflows also increases. Without integration tools, scientists and engineers are often highly concerned with how to integrate software tools and model sets, which hinders their original research or engineering aims. Therefore, a new framework for streamlining the creation and usage of automated computational workflows is introduced in the present article. It uses state-of-the-art technologies for automation (e.g., container-automation) and coordination (e.g., distributed message oriented middleware), and a microservice-based architecture for novel distributed process execution and coordination. It also supports co-simulations as part of larger workflows including additional auxiliary computational tasks, e.g., forecasting or data transformation. Using Apache NiFi, an easy-to-use web interface is provided to create, run and control workflows without the need to be concerned with the underlying computing infrastructure. Initial framework testing via the implementation of a real-world workflow underpins promising performance in the realms of parallelizability, low overheads and reliable coordination.https://www.mdpi.com/2076-3417/9/4/728automationmicroservicescomputing clusterenergy systemdata processingco-simulationparallelizationcoordination
spellingShingle Jianlei Liu
Eric Braun
Clemens Düpmeier
Patrick Kuckertz
D. Severin Ryberg
Martin Robinius
Detlef Stolten
Veit Hagenmeyer
Architectural Concept and Evaluation of a Framework for the Efficient Automation of Computational Scientific Workflows: An Energy Systems Analysis Example
Applied Sciences
automation
microservices
computing cluster
energy system
data processing
co-simulation
parallelization
coordination
title Architectural Concept and Evaluation of a Framework for the Efficient Automation of Computational Scientific Workflows: An Energy Systems Analysis Example
title_full Architectural Concept and Evaluation of a Framework for the Efficient Automation of Computational Scientific Workflows: An Energy Systems Analysis Example
title_fullStr Architectural Concept and Evaluation of a Framework for the Efficient Automation of Computational Scientific Workflows: An Energy Systems Analysis Example
title_full_unstemmed Architectural Concept and Evaluation of a Framework for the Efficient Automation of Computational Scientific Workflows: An Energy Systems Analysis Example
title_short Architectural Concept and Evaluation of a Framework for the Efficient Automation of Computational Scientific Workflows: An Energy Systems Analysis Example
title_sort architectural concept and evaluation of a framework for the efficient automation of computational scientific workflows an energy systems analysis example
topic automation
microservices
computing cluster
energy system
data processing
co-simulation
parallelization
coordination
url https://www.mdpi.com/2076-3417/9/4/728
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