mmtbx.chemical_components
index
/net/chevy/raid1/nat/src/cctbx_project/mmtbx/chemical_components/__init__.py

 
Package Contents
       
cif_parser
tst

 
Functions
       
find_data_dir()
generate_chemical_components_codes(sort_reverse_by_smiles=False)
get_alternative_name(code, name)
get_atom_names(code, alternate=False)
get_bond_pairs(code, alternate=False)
get_cif_dictionary(code, filename=None)
get_cif_filename(code)
get_field_simple(code, loop, field)
get_header(code)
get_hydrogen_names(code, wrap=False, alternate=False)
get_name(code)
get_smiles(code)
get_type(code)
is_code(code)
is_residue_specified(code, alternate=False)

 
Data
        data_dir = '/net/chevy/raid1/nat/src/chem_data/chemical_components'
division = _Feature((2, 2, 0, 'alpha', 2), (3, 0, 0, 'alpha', 0), 8192)
loaded_cifs = {}