exportpdb

pdb2sql_base.exportpdb(fname, append=False, tablename='atom', **kwargs)

Export a PDB file.

Parameters

• fname (str) – output filename

• append (bool) – append expored data to file or not

• kwargs –

  argument to select atoms, dict value must be list, e.g.:

  • name = [‘CA’, ‘O’]

  • no_name = [‘CA’, ‘C’]

  • chainID = [‘A’]

  • no_chainID = [‘A’]