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FormatConvert

Utility script for converting between file formats in ioNERDSS. The supported files are only the output .cif and .json from ioNERDSS, including regularized_coarse_grained_structure.cif and model.json

  • File types (e.g. .cif, .xyz, .pdb, .json, .gro, etc.)
  • Source vs target formats

Unit Test

Run unit test with:

python -m unittest discover -s tests

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Utility script for converting between file formats in NERDSS and ioNERDSS

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