drugforge.data.backend.openeye.load_openeye_design_unit

drugforge.data.backend.openeye.load_openeye_design_unit(du_fn: str | Path) → openeye.oechem.OEDesignUnit[source]

Load an OpenEye design unit from a file

Parameters:

du_fn (Union[str, Path]) – The path of the DesignUnit file to read.

Returns:

OpenEye DesignUnit

Return type:

oechem.OEDesignUnit

Raises:

  • FileNotFoundError – If the specified file does not exist.

  • oechem.OEError – If the CIF file cannot be opened.