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smiles..short form for
the simplified molecular input line entry specification..
a specification for unambiguously describing the structure of chemical molecules using short ASCII strings
|Canonical SMILES||Isomeric SMILES|
|the version of the SMILES specification that includes rules for ensuring that each distinct chemical molecule has a single unique SMILES representation||the version of the SMILES specification that includes extensions to support the specification of isotopes, chirality, and configuration about double bonds|
A common application of Canonical SMILES is for indexing and ensuring uniqueness of molecules in a database
|A notable feature of these rules is that they allow rigorous partial specification of chirality.|