TautomerizationRule.
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◆ getObjectID()
int CDPL.Chem.TautomerizationRule.getObjectID |
( |
| ) |
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Returns the numeric identifier (ID) of the wrapped C++ class instance.
Different Python TautomerizationRule instances may reference the same underlying C++ class instance. The commonly used Python expression a is not b
thus cannot tell reliably whether the two TautomerizationRule instances a and b reference different C++ objects. The numeric identifier returned by this method allows to correctly implement such an identity test via the simple expression a.getObjectID() != b.getObjectID()
.
- Returns
- The numeric ID of the internally referenced C++ class instance.
Reimplemented in CDPL.Chem.PatternBasedTautomerizationRule.
◆ getID()
int CDPL.Chem.TautomerizationRule.getID |
( |
| ) |
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◆ setup()
bool CDPL.Chem.TautomerizationRule.setup |
( |
MolecularGraph |
parent_molgraph | ) |
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◆ generate()
bool CDPL.Chem.TautomerizationRule.generate |
( |
Molecule |
tautomer | ) |
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Generates the next tautomer.
- Parameters
-
tautomer | The tautomer output molecule object. |
- Returns
True
if a tautomer was generated, False
if no more tautomers are available.
◆ clone()