Hello, everyone.

I find that rdkit cartridge is quite efficient in substructure searching.

Is there any paper or similar paper that describes things behind rdkit
cartridge?
For example, what kind of substructures were indexed?
Is there a way that the users can add custom defined fingerprints and
substructures?

Many thanks for your help!

Best,
Changge
_______________________________________________
Rdkit-discuss mailing list
Rdkit-discuss@lists.sourceforge.net
https://lists.sourceforge.net/lists/listinfo/rdkit-discuss

Reply via email to