mdciao.examples

Helper functions for demos and data download

ContactGroupL394	Create an example mdciao.contacts.ContactGroup quickly.
Interface_B2AR_Gas	Return an ContactGroup object representing a B2AR-Galpha s interface
GPCRLabeler_ardb2_human	Build an LabelerGPCR with the adrb2_human.xlsx file shipped with mdciao
CGNLabeler_3SN6	Build an LabelerCGN with the CGN_3SN6.txt and 3SN6.pdb files shipped with mdciao
notebooks	Copy the example Jupyter notebooks distributed with mdciao to this folder.
fetch_example_data	Download the example data as zipfile and unzip it to the working directory.
filenames	A class that contains the paths to the files used by mdciao.