Module MolKey
Classes
BadMoleculeException
MolIdentifierException
Functions
CheckCTAB
ErrorBitsToText
GetInchiForCTAB
GetKeyForCTAB
initStruchk
Variables
BAD_SET
CHIRAL_POS
ERROR_DICT
GET_STEREO_RE
INCHI_COMPUTATION_ERROR
INCHI_READWRITE_ERROR
InchiResult
MOL_KEY_VERSION
MolKeyResult
NULL_MOL
NULL_SMILES_RE
PATTERN_NULL_MOL
RDKIT_CONVERSION_ERROR
T_NULL_MOL
stereo_code_dict
[hide private]