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Create a new example that will run full ADF package (not from notebook) #141

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Commits on Oct 10, 2024

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  4. Add link_to_ADF notebook

    This notebook should inject a link to the actual ADF output webpage into the
    jupyter book
    mnlevy1981 committed Oct 10, 2024
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Commits on Oct 14, 2024

  1. Pass pre-commit tests

    cleaned up a couple files that were triggering pre-commit fails
    mnlevy1981 committed Oct 14, 2024
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Commits on Oct 23, 2024

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Commits on Nov 4, 2024

  1. Update link to ADF

    TeaganKing authored Nov 4, 2024
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Commits on Nov 8, 2024

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  2. hide input for cell generating link

    hide input and output for imports, and input for cell that will eventually have
    plots as output
    mnlevy1981 committed Nov 8, 2024
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  3. Fix adf_root in notebook and config file

    Notebook was linking to adf_root before updating the value from config.yml;
    config.yml should set the default to where we expect ADF to write webpage
    (which is in the same directory tree that CUPiD writes webpage)
    mnlevy1981 committed Nov 8, 2024
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  4. links to ADF working now

    TeaganKing committed Nov 8, 2024
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  5. adf website copied

    TeaganKing committed Nov 8, 2024
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  7. use adf flag

    TeaganKing committed Nov 8, 2024
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Commits on Nov 13, 2024

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Commits on Nov 15, 2024

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  2. Pass some config options to external tools

    instead of
    
    adf_run: True
    adf_vars: ['...', '...']
    
    Introduced
    
    external_tool:
      tool_name: 'ADF'
      vars: ['...', '...']
    
    I also moved this out of parameter_group since it's not needed by the
    link_to_ADF.ipynb notebook (and added plotting_scripts: ['...', '...'] as an
    extra option to set in config.yml)
    mnlevy1981 committed Nov 15, 2024
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