qp.structure.setup

Fetch PDB and perform quality checks

Functions

fetch_pdb

Fetches the PDB file for a given PDB code.

get_centers

Parses the input centers and returns a list of the center residue PDB IDs.

get_pdbs

Parses the input PDBs and returns a list of tuples

parse_input

Parse input sources and determine center residues for each structure.

read_config

Read and parse a YAML configuration file.