From: Jurgens de B. <deb...@gm...> - 2011-08-24 08:19:01
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Hi, I am searching for a number of active groups in molecules using smarts and it so happens that some of the groups overlap. Thus would it be possible to write a smart stating to find a group but it should not be part of another group. smartA = "Some Smart" SmartB ='SecondSmart not part of SmartA' Thanks -- Regards/Groete/Mit freundlichen Grüßen/recuerdos/meilleures salutations/ distinti saluti/siong/duì yú/привет Jurgens de Bruin |