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mcal documentation
mcal documentation

API Reference

  • mcal
    • mcal package
      • mcal.calculations package
      • mcal.utils package
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All modules for which code is available

  • mcal.calculations.hopping_mobility_model
  • mcal.calculations.rcal
  • mcal.mcal
  • mcal.utils.cif_reader
  • mcal.utils.gaus_log_reader
  • mcal.utils.gjf_maker
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