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{bio}[system/system] SIRIUS-MS v6.3.3#24330

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bedroge:20251021151534_new_pr_SIRIUS-MS633
Oct 21, 2025
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{bio}[system/system] SIRIUS-MS v6.3.3#24330
Micket merged 3 commits intoeasybuilders:developfrom
bedroge:20251021151534_new_pr_SIRIUS-MS633

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@bedroge bedroge commented Oct 21, 2025 •
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(created using eb --new-pr)

The name SIRIUS is already taken (https://github.com/easybuilders/easybuild-easyconfigs/tree/develop/easybuild/easyconfigs/s/SIRIUS), so I used SIRIUS-MS (mass spectroscopy) instead. This is also used as the Github organization name (https://github.com/sirius-ms/sirius).

@bedroge bedroge added the new label Oct 21, 2025
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bedroge commented Oct 21, 2025

Test report by @bedroge
SUCCESS
Build succeeded for 1 out of 1 (1 easyconfigs in total)
bob-Latitude-5300 - Linux Ubuntu 25.04 (Plucky Puffin), x86_64, Intel(R) Core(TM) i7-8665U CPU @ 1.90GHz, Python 3.13.3
See https://gist.github.com/bedroge/a542cf73adc576d3cde1906d16d39629 for a full test report.

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bedroge commented Oct 21, 2025

@boegelbot please test @ jsc-zen3

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boegelbot commented Oct 21, 2025

@bedroge: Request for testing this PR well received on jsczen3l1.int.jsc-zen3.fz-juelich.de

PR test command 'if [[ develop != 'develop' ]]; then EB_BRANCH=develop ./easybuild_develop.sh 2> /dev/null 1>&2; EB_PREFIX=/home/boegelbot/easybuild/develop source init_env_easybuild_develop.sh; fi; EB_PR=24330 EB_ARGS= EB_CONTAINER= EB_REPO=easybuild-easyconfigs EB_BRANCH=develop /opt/software/slurm/bin/sbatch --job-name test_PR_24330 --ntasks=8 ~/boegelbot/eb_from_pr_upload_jsc-zen3.sh' executed!

  • exit code: 0
  • output:
Submitted batch job 8504

Test results coming soon (I hope)...

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boegelbot commented Oct 21, 2025

Test report by @boegelbot
SUCCESS
Build succeeded for 1 out of 1 (1 easyconfigs in total)
jsczen3c1.int.jsc-zen3.fz-juelich.de - Linux Rocky Linux 9.6, x86_64, AMD EPYC-Milan Processor (zen3), Python 3.9.21
See https://gist.github.com/boegelbot/d0252f2de722bb4f07b07a96d43fe879 for a full test report.

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Thyre commented Oct 21, 2025

There is an aarch64 download as well. I'd guess we should add this to this EasyConfig, so that we can use just this single one if we ever need this as a dependency / builddependency.

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bedroge commented Oct 21, 2025

There is an aarch64 download as well. I'd guess we should add this to this EasyConfig, so that we can use just this single one if we ever need this as a dependency / builddependency.

Ah, good point, I'll add that.

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bedroge commented Oct 21, 2025

Test report by @bedroge
SUCCESS
Build succeeded for 1 out of 1 (1 easyconfigs in total)
bob-Latitude-5300 - Linux Ubuntu 25.04 (Plucky Puffin), x86_64, Intel(R) Core(TM) i7-8665U CPU @ 1.90GHz, Python 3.13.3
See https://gist.github.com/bedroge/460c88e1211faca864e9419090e333b7 for a full test report.

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bedroge commented Oct 21, 2025

There is an aarch64 download as well. I'd guess we should add this to this EasyConfig, so that we can use just this single one if we ever need this as a dependency / builddependency.

Done in 8ed570d and b72f080. Also removed the versionsuffix.

@bedroge bedroge changed the title {bio}[system/system] SIRIUS-MS v6.3.3 w/ linux x64 {bio}[system/system] SIRIUS-MS v6.3.3 Oct 21, 2025
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Micket approved these changes Oct 21, 2025
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lgtm

@Micket Micket added this to the next release (5.2.0?) milestone Oct 21, 2025
@Micket Micket merged commit 78a351e into easybuilders:develop Oct 21, 2025
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@bedroge bedroge deleted the 20251021151534_new_pr_SIRIUS-MS633 branch October 22, 2025 05:23
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Micket commented Feb 19, 2026

Test report by @Micket
SUCCESS
Build succeeded for 1 out of 1 (total: 43 secs) (1 easyconfigs in total)
vera-icelake-build - Linux Rocky Linux 9.6, x86_64, Intel(R) Xeon(R) Silver 4316 CPU @ 2.30GHz, Python 3.9.21
See https://gist.github.com/Micket/84ed5a1ecdf69a6f7e60f1d9463952f2 for a full test report.

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