mordred.BalabanJ module

class mordred.BalabanJ.BalabanJ

Bases: mordred._base.descriptor.Descriptor

Balaban’s J index descriptor(rdkit wrapper).

explicit_hydrogens = False

rtype

alias of float

from_json(obj)

create Descriptor instance from json dict.

Parameters:obj (dict) – descriptor dict Returns:descriptor Return type:Descriptor

get_parameter_dict()

kekulize = False

parameter_names = ()

require_3D = False

require_connected = False

to_json()

convert to json serializable dictionary.

Returns:dictionary of descriptor Return type:dict