FlowCron - Increasing access to HPC by wrapping Globus into a function-as-a-service.

Q1 Medicine Wellcome Open Research Pub Date : 2025-12-02 eCollection Date: 2025-01-01 DOI:10.12688/wellcomeopenres.23491.2
Dimitrios Bellos, James Allsopp, Elaine M L Ho, Tibor Auer, Gavin Yearwood, Andrew J Morris, Mark Basham
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Abstract

Despite significant investment in High-Performance Computing (HPC) clusters by funding councils, there are still many researchers whose workflows could not benefit from the computation speed that is provided by these clusters. Reducing barriers to entry for these researchers would accelerate their scientific throughput, since they will be able to respond to results in a timely fashion, improving either their protocols or correcting any problems that might have arisen. This improves the quality of science, and therefore the return on investment, in computationally-intensive areas such as Cryogenic Electron Microscopy (cryo-EM). This paper outlines a technique, FlowCron, for users to analyse their data on a HPC facility with reduced training, increasing accessibility. FlowCron transfers the responsibilities of installation and upkeep of data processing pipelines from users to HPC project PIs and/or HPC project managers, simplifies the set up of HPC pipelines, and makes pipelines as reliable as possible once set up. The work described here has software dependencies that are common to the majority of HPC clusters. We achieve this by linking Globus and cron to produce an open-source system that requires little administrative support but provides a very easy way of running an analysis on a HPC system. The user starts the analysis through the Globus website and, when started, the data will be encrypted, uploaded to the HPC, analysed, and returned to the originating machine, along with a record of the analysis. For Globus to transfer any data to and from the HPC, appropriate user authentication is required, thus ensuring that only authorised users can send data in the HPC.

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FlowCron——通过将Globus包装成一个函数即服务来增加对HPC的访问。
尽管基金委员会对高性能计算(HPC)集群进行了大量投资,但仍然有许多研究人员的工作流程无法从这些集群提供的计算速度中受益。降低对这些研究人员的准入门槛将加快他们的科学产出,因为他们将能够及时对结果作出反应,改进他们的方案或纠正可能出现的任何问题。这提高了科学的质量,从而提高了在诸如低温电子显微镜(cryo-EM)等计算密集型领域的投资回报。本文概述了一种名为FlowCron的技术,用户可以通过最少的培训在高性能计算设备上分析他们的数据,从而增加了可访问性。FlowCron将数据处理管道的安装和维护责任从用户转移到HPC系统管理员,简化了HPC管道的设置,并使管道在设置后尽可能可靠。这里描述的工作具有大多数HPC集群常见的软件依赖关系。我们通过连接Globus和cron来生成一个开源系统,该系统需要很少的管理支持,但提供了一种在HPC系统上运行分析的非常简单的方法。用户通过Globus网站开始分析,当启动时,数据将被加密,上传到HPC,进行分析,并连同分析记录一起返回到原始机器。
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来源期刊
Wellcome Open Research
Wellcome Open Research Biochemistry, Genetics and Molecular Biology-Biochemistry, Genetics and Molecular Biology (all)
CiteScore
5.50
自引率
0.00%
发文量
426
审稿时长
1 weeks
期刊介绍: Wellcome Open Research publishes scholarly articles reporting any basic scientific, translational and clinical research that has been funded (or co-funded) by Wellcome. Each publication must have at least one author who has been, or still is, a recipient of a Wellcome grant. Articles must be original (not duplications). All research, including clinical trials, systematic reviews, software tools, method articles, and many others, is welcome and will be published irrespective of the perceived level of interest or novelty; confirmatory and negative results, as well as null studies are all suitable. See the full list of article types here. All articles are published using a fully transparent, author-driven model: the authors are solely responsible for the content of their article. Invited peer review takes place openly after publication, and the authors play a crucial role in ensuring that the article is peer-reviewed by independent experts in a timely manner. Articles that pass peer review will be indexed in PubMed and elsewhere. Wellcome Open Research is an Open Research platform: all articles are published open access; the publishing and peer-review processes are fully transparent; and authors are asked to include detailed descriptions of methods and to provide full and easy access to source data underlying the results to improve reproducibility.
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