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mosdef-hub / foyer

A package for atom-typing as well as applying and disseminating forcefields
https://foyer.mosdef.org
MIT License
119 stars 78 forks source link

Pin openmm to 7.5 #455

Closed jennyfothergill closed 3 years ago

jennyfothergill commented 3 years ago

PR Summary:

New openmm release causing issue in reproducibility study, so let's pin the version until we can determine what the error is.

codecov[bot] commented 3 years ago

Codecov Report

Merging #455 (40189e8) into master (b55b416) will not change coverage. The diff coverage is n/a.

:exclamation: Current head 40189e8 differs from pull request most recent head b2c02f7. Consider uploading reports for the commit b2c02f7 to get more accurate results

@@           Coverage Diff           @@
##           master     #455   +/-   ##
=======================================
  Coverage   73.87%   73.87%           
=======================================
  Files          17       17           
  Lines        1849     1849           
=======================================
  Hits         1366     1366           
  Misses        483      483
justinGilmer commented 3 years ago

/azp run

azure-pipelines[bot] commented 3 years ago
Azure Pipelines successfully started running 1 pipeline(s).