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Sage 2.0 #14

Merged
merged 7 commits into from
Nov 19, 2024
Merged

Sage 2.0 #14

merged 7 commits into from
Nov 19, 2024

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ntBre
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@ntBre ntBre commented Nov 19, 2024

In addition to a Sage 2.0 benchmark, this PR also includes a new script for generating a submission directory and README entry, and bumps yammbs to 0.1.1.

Submission Checklist

  • Created a new directory in the submissions directory containing the YDS input file and optionally a force field .offxml file
  • Triggered the benchmark workflow with a PR comment of the form /run-benchmark path/to/submission
  • Waited for the workflow to finish and a comment with Job status: success to be posted
  • Reviewed the results committed by the workflow
  • Published the corresponding Zenodo entry and retrieved the DOI
  • Added the Zenodo DOI to the table in the main README
  • Ready to merge!

@ntBre
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ntBre commented Nov 19, 2024

/run-benchmark submissions/2024-11-19-Sage-2.0.0/input.yaml

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A workflow has been dispatched to run the benchmarks for this PR.

  • Run ID: 11919622472
  • Triggering actor: github-actions[bot]
  • Target branch: sage-2.0

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A workflow dispatched to run benchmarks for this PR has just finished.

@ntBre
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ntBre commented Nov 19, 2024

/run-benchmark submissions/2024-11-19-Sage-2.0.0/input.yaml

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A workflow has been dispatched to run the benchmarks for this PR.

  • Run ID: 11919740364
  • Triggering actor: github-actions[bot]
  • Target branch: sage-2.0

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A workflow dispatched to run benchmarks for this PR has just finished.

@ntBre ntBre merged commit 167c226 into master Nov 19, 2024
@ntBre ntBre deleted the sage-2.0 branch November 21, 2024 15:38
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