[OTDev] Classified + Urgent

chung chvng at mail.ntua.gr
Sun Jul 11 05:33:03 CEST 2010


Hi Nina, All,
 I'm using ambit.uni-plovdiv.bg as a default but you can configure it
from the editor options ;) I attach the latest version of the editor (as
a jar) to let you have a better insight on its structure and initial
functionalities.

At http://en.wikipedia.org/wiki/Benzene if found that that the SMILES
string of Benzene is 'c1ccccc1', while at
http://www-jmg.ch.cam.ac.uk/data/molecules/misc/cyclohexane.html it says
that 'C1CCCCC1' is the smiles for cyclohexane. Is smiles case sensitive?

Regards,
Pantelis

On Sat, 2010-07-10 at 09:19 +0300, Nina Jeliazkova wrote:
> Hi Pantelis, All,
> 
> Could you tell how did you generated the image?  Depiction via ambit web
> services generates has a correct aromaticity (
> http://ambit.uni-plovdiv.bg:8080/ambit2/depict?search=c1ccccc1cccc
> or
> http://apps.ideaconsult.net:8080/ambit2/depict?search=c1ccccc1cccc
> ).
> 
> Best regards,
> Nina
> 
> 
> 
> On Fri, Jul 9, 2010 at 11:20 PM, chung <chvng at mail.ntua.gr> wrote:
> 
> > Hi All,
> >  Take a look at the screenshot (attached)... Depiction automatically
> > generated by AMBIT WS...
> >
> > Cheers,
> > NTUA Development Team
> >
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> >
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