OESLNFlag¶

This namespace contains constants.

Isotopes

Controls whether isotopic mass is written to the generated SLN strings.

Hydrogens

Controls whether explicit hydrogens are automatically suppressed and written to the SLN string as part of an atom’s implicit hydrogen count.

Canonical

Controls whether we attempt to generate canonical SLN strings.

Kekule

Controls whether we generate Kekulé or aromatic SLN strings. The OECreateSlnString function uses the currently assigned aromaticity model. Ideally, from compatibility with Tripos generated SLN, the user should assign Tripos aromaticity to the molecule when writing aromatic SLN, calling the function OEAssignAromaticFlags with OEChem.OEAroModelTripos aromaticity model.

Name

Controls whether we append the SLN name attribute to the end of each SLN string.

FCharge

Controls whether we output the partial charge on each atom.

Coords2D

Coords3D

DEFAULT

The default value, OESLNFlag.DEFAULT currently contains the flavor OESLNFlag.Name.