set_ccd_path
#
- biotite.structure.info.set_ccd_path(ccd_path)[source]#
Replace the internal Chemical Component Dictionary (CCD) with a custom one.
This function also clears the cache of functions depending on the CCD to ensure that the new CCD is used.
- Parameters:
- ccd_pathpath-like
The path to the custom CCD in BinaryCIF format, prepared with the
setup_ccd.py
module.
Notes
This function is intended for advanced users who need to add information for compounds, which are not part of the internal CCD. The reason might be that an updated version already exists upstream or that the user wants to add custom compounds to the CCD.