OEAddDockingInteractions

bool OEAddDockingInteractions(OEBio::OEInteractionHintContainer &asite)

Perceives interactions (contact, hydrogen bonding, chelator) between the two molecules stored in the OEInteractionHintContainer object.

See also

• OEPerceiveInteractionHints function of OEChem TK

• Example in the Perceive and Print Protein-Ligand Interactions section of the OEChem TK manual about accessing the interactions.

• Example in the Depicting Active Site Interactions section of the Grapheme TK manual about visualizing the interactions.