From: Anand <an...@av...> - 2008-06-16 08:18:57
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Dear Noel, I am actually forming an fs file of the output and command line that i use is babel database.fs -sSMILES output.smi Regards Anand ----- Original Message ----- From: "Noel O'Boyle" <bao...@gm...> To: "Anand" <an...@av...> Cc: <Ope...@li...> Sent: Sunday, June 15, 2008 1:35 AM Subject: Re: [OpenBabel-scripting] reg: Fast search options > Hello Anand, > > Are you using the command line 'babel' or a scripting language? What > commands are you using? What error message are you getting? > > (please Reply All) > > Regards, > Noel > > 2008/6/12 Anand <an...@av...>: >> Greetings, >> >> Hi everyone, >> >> I am interested in doing a fast search against of a host of smiles >> converted >> to fs format.But unfortunately the result size does not exceed 4000. Is >> this >> the wholesome limit or is it possible to increase the limit for >> substructure >> searching. >> >> Is there any alternate way to acheive this >> >> Regards >> Anand >> ------------------------------------------------------------------------- >> Check out the new SourceForge.net Marketplace. >> It's the best place to buy or sell services for >> just about anything Open Source. >> http://sourceforge.net/services/buy/index.php >> _______________________________________________ >> OpenBabel-scripting mailing list >> Ope...@li... >> https://lists.sourceforge.net/lists/listinfo/openbabel-scripting >> >> > |