OEGetEstimatedPositProbability

double OEGetEstimatedPositProbability(const OEChem::OEMCMolBase& ligand,
                                      const OEBio::OEDesignUnit& du)
double OEGetEstimatedPositProbability(const OEChem::OEMCMolBase& ligand,
                                      const OEChem::OEMolBase& receptor)

Given a multi conformer ligand and a receptor, return the probability that, if the ligand binds to the receptor, the binding pose of the ligand can be retrieved.

This function is helpful in selecting a receptor to pose against from a group of receptors.