[OTDev] Classified + Urgent

Nina Jeliazkova jeliazkova.nina at gmail.com
Sat Jul 10 12:06:27 CEST 2010


On Sat, Jul 10, 2010 at 12:41 AM, Rajarshi Guha <rajarshi.guha at gmail.com>wrote:

> Missing aromaticity
>
>
Yes, here is a comparison between The CDK , Daylight and CACTVS structure
diagrams, generated from the same smiles:

http://apps.ideaconsult.net:8080/ambit2/depict?search=c1cccccc1ccccc

Could someone tell which is the (most) correct one ?

Regards,
Nina



>
> On Jul 9, 2010, at 4:20 PM, chung wrote:
>
>  Hi All,
>>  Take a look at the screenshot (attached)... Depiction automatically
>> generated by AMBIT WS...
>>
>> Cheers,
>> NTUA Development Team
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>
> ----------------------------------------------------
> Rajarshi Guha        | NIH Chemical Genomics Center
> http://www.rguha.net | http://ncgc.nih.gov
> ----------------------------------------------------
> Gravity brings me down.
>
>
>
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