Not sure what you're acting exactly. You can specify isotopes in smiles ( http://daylight.com/dayhtml/doc/theory/theory.smiles.html ).
If you want images of the structures that show what is an isotope, you can compare the images produced by these two commands. $ obabel -:C[14C]C[14C] -O isotope.png $ obabel -:CCCC -O noisotope.png -David On Tue, Feb 25, 2014 at 12:53 PM, Shamal A Mehta <sme...@ebiochemica.com>wrote: > Is there a way to generate structures of radiolabelled compounds where > once can clearly delineate the radiolabelled atom using Open Babel via > Inchi, Smiles, Ismiles or Csmiles. Any help would be appreciated > > > > > > Thank you, > > Respectfully yours, > > > > *Shamal Mehta Ph.D. * > > Chief Executive Officer > > [image: cid:image001.jpg@01CA79AB.1FEC7880] > > *eBiochemica Solutions Pvt. Ltd * > > *144 Venus Apts, 87 Cuffe Parade, Mumbai 400005 India * > > *Phone: 91-20-64014245|PhoneFax: 91-20-27207274 |Skype: ebiochemica* > > *Phone: 858-847-0392 <858-847-0392> |Fax: 858-225-4607 <858-225-4607> * > > *E-mail: **sme...@ebiochemica.com* <sme...@ebiochemica.com>* |Website: * > *www.ebiochemica.com* <http://www.ebiochemica.com/> > > > > *Disclaimer* > > This communication is confidential and may contain privileged information > intended solely for the named addressee(s). It may not be used or disclosed > except for the purpose for which it has been sent. If you are not the > intended recipient you must not review, use, disclose, copy, distribute or > take any action in reliance upon it. If you have received this > communication in error, please notify eBiochemica Solutions Pvt. Ltd by > emailing i...@ebiochemica.com <sme...@ebiochemica.com> and destroy all > copies of the message and any attached documents. > > eBiochemica Solutions Pvt. Ltd monitors, controls and protects all its > messaging traffic in compliance with its corporate email policy. The > Company accepts no liability or responsibility for any onward transmission > or use of emails and attachments having left the eBiochemica Solutions Pvt. > Ltd domain. Unless expressly stated, opinions in this message are those of > the individual sender and not of eBiochemica Solutions Pvt. Ltd. The > recipient should check this email and any attachments for the presence of > computer viruses. eBiochemica Solutions Pvt. Ltd accepts no liability for > damage caused by any virus transmitted by this email. E-mail is susceptible > to data corruption, interception, unauthorized amendment, and tampering, > eBiochemica Solutions Pvt. Ltd only send and receive e-mails on the basis > that the Company is not liable for any such alteration or any consequences > thereof. If you have received this communication in error, please > immediately notify us by telephone 91-20-27207274, and destroy the original > message. Please visit our website for any additional information that you > may require. Thank you. > > > > > ------------------------------------------------------------------------------ > Flow-based real-time traffic analytics software. Cisco certified tool. > Monitor traffic, SLAs, QoS, Medianet, WAAS etc. with NetFlow Analyzer > Customize your own dashboards, set traffic alerts and generate reports. > Network behavioral analysis & security monitoring. All-in-one tool. > > http://pubads.g.doubleclick.net/gampad/clk?id=126839071&iu=/4140/ostg.clktrk > _______________________________________________ > OpenBabel-discuss mailing list > OpenBabel-discuss@lists.sourceforge.net > https://lists.sourceforge.net/lists/listinfo/openbabel-discuss > >
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------------------------------------------------------------------------------ Flow-based real-time traffic analytics software. Cisco certified tool. Monitor traffic, SLAs, QoS, Medianet, WAAS etc. with NetFlow Analyzer Customize your own dashboards, set traffic alerts and generate reports. Network behavioral analysis & security monitoring. All-in-one tool. http://pubads.g.doubleclick.net/gampad/clk?id=126839071&iu=/4140/ostg.clktrk
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