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changes.mady.by.user David Dotson

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  •  David Dotson will investigate slow behavior of torsiondrive script for simple molecules; follow up with Xavier Lucas
  •  Jeffrey Wagner will finish coverage reporter PR prototyped by Joshua Horton
  •  Jeffrey Wagner will review and merge conformer generation PR prepared by Joshua Horton
  •  David Dotson will work with David Hahn to address compute issues, find working pathway at Janssen
  •  David Hahn will fill in analysis instructions in protocol
  •  Joshua Horton will make it possible for OptimizationDataset.add_molecule to leave IDs alone under single-conformer conditions
  •  Joshua Horton will address smirnoff99Frosst-1.1.0 spec failure in QCSubmit

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