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Added support for using local data files. #170

Merged
merged 2 commits into from
Jun 26, 2024
Merged

Added support for using local data files. #170

merged 2 commits into from
Jun 26, 2024

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paulsaxe
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  • Added support in the Flowchart and Node classes for using local data files for e.g. forcefields. This allows the user to specify a local file, which is copied to the working directory of the job.
  • Also added a flag to both the Flowchart and Node classes indicating that the job is running in the JobServer rather than command-line.

paulsaxe added 2 commits June 26, 2024 17:20
@paulsaxe
Added support for using local data files.
797a1a8 
    * Added support in the Flowchart and Node classes for using local data files for
      e.g. forcefields. This allows the user to specify a local file, which is copied to
      the working directory of the job.
    * Also added a flag to both the Flowchart and Node classes indicating that the job
      is running in the JobServer rather than command-line.
@paulsaxe
Added support for using local data files.
392dc22 
    * Added support in the Flowchart and Node classes for using local data files for
      e.g. forcefields. This allows the user to specify a local file, which is copied to
      the working directory of the job.
    * Also added a flag to both the Flowchart and Node classes indicating that the job
      is running in the JobServer rather than command-line.
@paulsaxe paulsaxe added the enhancement New feature or request label Jun 26, 2024
@paulsaxe paulsaxe requested a review from seamm June 26, 2024 21:28
seamm
seamm approved these changes Jun 26, 2024
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LGTM

@seamm seamm merged commit ffb08dc into main Jun 26, 2024
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@seamm seamm seamm approved these changes

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@paulsaxe @seamm