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README
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README.md
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README.md
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its family, the nature of the excited states, the size of the basis
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set, etc.
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### The tools
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[tools](tools/) a series of python scripts used to generate data:
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- `datafileBuilder`: A python script to generate data from custom LaTeX input
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file. See [examples](docs/examples).
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- `metarecover`: A python script is used to regenerate the metadata from the
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previous git history state. So you can remove a data file to regenerate it
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from a LaTeX input file with `datafileBuilder` and recover the metadata
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from the previous version using `metarecover`.
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- `ADC25generator`: script used to build `ADC(2.5)` data files from `ADC(2)` and `ADC(3)` data files.
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- `generate_data`: script used to wrap all data file into one `database.json` file.
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tools/README.md
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This directory contains a series of Python scripts used to generate data:
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- `datafileBuilder`: A python script to generate data from custom LaTeX input
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file. See [examples](docs/examples).
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- `metarecover`: A python script is used to regenerate the metadata from the
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previous git history state. So you can remove a data file to regenerate it
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from a LaTeX input file with `datafileBuilder` and recover the metadata
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from the previous version using `metarecover`.
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- `ADC25generator`: script used to build `ADC(2.5)` data files from `ADC(2)` and `ADC(3)` data files.
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- `generate_data`: script used to wrap all data file into one `database.json` file.
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