[Rdkit-discuss] Get Bond order

Dear All . I want to know how to get bond order of molecules. GetBondType method can get bond-type SINGLE, DOUBLE, TRIPLE , but can't get bond order. Are there any idea to solve it ? Thanks. Takayuki -- How

[Rdkit-discuss] substructure search with fingerprints in C++

Hi all, Could anyone provide some advice about how to run (fast but approximate) substructure searches with fingerprints using C++? I have a large set of SMILES for molecules and a relatively large set of SMILES/SMARTS for substructures. Thanks a lot, Gonzalo