.IsRdkitAvailable       Check whether RDKit is available
CalculateAllDescriptors
                        Calculate all RDKit molecular descriptors
CalculateExactMass      Calculate the exact mass of molecules
CalculateMaccsFingerprints
                        Calculate MACCS fingerprints for a set of
                        molecules
CalculateMolecularWeight
                        Calculate the average molecular weight of
                        molecules
CalculateMorganFingerprints
                        Calculate Morgan fingerprints for a set of
                        molecules
CalculateRdkitFingerprints
                        Calculate RDKit topological fingerprints for a
                        set of molecules
ConvertToInchi          Convert molecules to InChI strings
ConvertToInchikey       Convert molecules to InChIKey strings
ConvertToSmiles         Convert molecules to SMILES strings
GetPythonInfo           Get information about the currently used Python
                        environment
ParseMolecules          Parse SMILES and InChI strings into RDKit Mol
                        objects
test_compounds          Test compounds
