CCL: Structures or connectivity tables toSMILES



May be this may gives some idea. even i am intersted in generate SMILES strings
I would appreciate any help.

http://openbabel.sourceforge.net/




On 11/28/05, kalpana krishnaswami kkalpana|-|vsnl.net <owner-chemistry]-[ccl.net> wrote:
Sent to CCL by: "kalpana  krishnaswami" [kkalpana ~~ vsnl.net]
I need a method to generate SMILES strings for a large number of structures.  Does anyone know a way of doing this.  Either a stand alone program that would  read a text file(eg, SD file)  or a class or component that we could access programatically that would work.  I would appreciate any help.

Regards
Kalpana



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