OEMDLPerceiveBondStereoΒΆ

bool OEMDLPerceiveBondStereo(OEMolBase &mol)

Assigns wedge and hash bonds to a connection table from the OEChem TK stereochemistry of each atom. This function requires that the molecule have 2D coordinates. See example in Figure: Example of using OEMDLPerceiveBondStereo

../../_images/OEMDLPerceiveBondStereo.png

Example of using OEMDLPerceiveBondStereo: before (A) and after (B) calling the OEMDLPerceiveBondStereo function

Note

This function is the opposite of the OEMDLStereoFromBondStereo function.

See also

Note

The OEMDLPerceiveBondStereo function preserves wavy bonds (OEBondStereo.Wavy). These can only be removed by calling the OEMDLClearBondStereo function.