ncsw_data.source.reaction.crd.utility ===================================== .. py:module:: ncsw_data.source.reaction.crd.utility .. autoapi-nested-parse:: The ``ncsw_data.source.reaction.crd.utility`` package initialization module. Submodules ---------- .. toctree:: :maxdepth: 1 /autoapi/ncsw_data/source/reaction/crd/utility/download/index /autoapi/ncsw_data/source/reaction/crd/utility/extraction/index /autoapi/ncsw_data/source/reaction/crd/utility/formatting/index Classes ------- .. autoapisummary:: ncsw_data.source.reaction.crd.utility.ChemicalReactionDatabaseDownloadUtility ncsw_data.source.reaction.crd.utility.ChemicalReactionDatabaseExtractionUtility ncsw_data.source.reaction.crd.utility.ChemicalReactionDatabaseFormattingUtility Package Contents ---------------- .. py:class:: ChemicalReactionDatabaseDownloadUtility The `Chemical Reaction Database (CRD) `_ download utility class. .. py:method:: download_v_reaction_smiles(version: str, output_directory_path: Union[str, os.PathLike[str]]) -> None :staticmethod: Download the data from a `v_reaction_smiles_*` version of the database. :parameter version: The version of the database. :parameter output_directory_path: The path to the output directory where the data should be downloaded. .. py:class:: ChemicalReactionDatabaseExtractionUtility The `Chemical Reaction Database (CRD) `_ extraction utility class. .. py:method:: extract_v_reaction_smiles(version: str, input_directory_path: Union[str, os.PathLike[str]], output_directory_path: Union[str, os.PathLike[str]]) -> None :staticmethod: Extract the data from a `v_reaction_smiles_*` version of the database. :parameter version: The version of the database. :parameter input_directory_path: The path to the input directory where the data is downloaded. :parameter output_directory_path: The path to the output directory where the data should be extracted. .. py:class:: ChemicalReactionDatabaseFormattingUtility The `Chemical Reaction Database (CRD) `_ formatting utility class. .. py:method:: format_v_reaction_smiles(version: str, input_directory_path: Union[str, os.PathLike[str]], output_directory_path: Union[str, os.PathLike[str]]) -> None :staticmethod: Format the data from a `v_reaction_smiles_*` version of the database. :parameter version: The version of the database. :parameter input_directory_path: The path to the input directory where the data is extracted. :parameter output_directory_path: The path to the output directory where the data should be formatted.