Interface SmilesGeneratorOptions

interface SmilesGeneratorOptions {
    createSmarts?: boolean;
    includeMapping?: boolean;
    kekulizedOutput?: boolean;
}

Properties

createSmarts?: boolean

Whether to create SMILES with SMARTS capabilities.

false

includeMapping?: boolean

Whether to include mapping information (atomMapNo) in the SMILES.

false

kekulizedOutput?: boolean

Should localisation of double bonds be attempted?

false