Adding lipid aux and core datasets for benchmarking

[JHoeflich1]

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]

Looks good to me! I'll start one of them, and if it starts running okay, I'll kick off the second one too. You should see a couple of comments from the bot indicating that the jobs started and eventually finished, and then there will be new commits adding the results!

[ntBre]

/run-optimization-benchmarks submissions/2024-12-19-Sage-2.2.1-lipids-aux/input.yaml

[github-actions]

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

• Run ID: 12418830094
• Triggering actor: github-actions[bot]
• Target branch: master

[github-actions]

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

• Run ID: [12418830094]
• Triggering actor: github-actions[bot]
• Target branch: master
• Job status: failure
  [12418830094]: https://github.com/openforcefield/yammbs-dataset-submission/actions/runs/12418830094