CCL: STRUCTURES TO SMILES



"There is no relationship between a CAS name and its structure - it's just an index into the CAS database"

This is wrong.
I think that CAS index name and CAS registry numbers have got confused.
A CAS name is very related to the structure of the compund

Sriramamurthy.Boppana
CambridgeSoft (Q3 Tech.India)

On 11/26/05, M. Nicklaus mn1-.-helix.nih.gov < owner-chemistry##ccl.net> wrote:
Sent to CCL by: "M. Nicklaus" [mn1!^!helix.nih.gov]
Check out:

http://cactus.nci.nih.gov/services/translate/

Marc Nicklaus


On Fri, 25 Nov 2005, ragubalaji n ragubalaji_._gmail.com wrote:

> Sent to CCL by: "ragubalaji  n" [ragubalaji::gmail.com]
> Hi all,
>
> I am looking for tool where SMILES strings  can be generated > from  structures or connectivity tables.  Could anybody tell me where I can find it?
> Thank you very much.
>
> ragu
> Bangalore
> ragubalaji[#]gmail.com>
>



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ram