Behind the Scenes ...

Molecule Type:

• Data Struct
• Unique SMILES
• Fingerprint
• etc...
• IN<->OUT Through the Server is a Unique SMILES

 

SQL FUNCTION Extensions:

Select Molecule from HIVTable
    where FindAsSub('c1ccccc1',Molecule);
 
 Select Molecule from HIVTable
    where FindAsSuper('CNc1ncnc2n(C=C=CCO)cnc12',Molecule);

Select Molecule, thorlookup(Molecule) from HIVTable;