Miriame, this is a bug that has been introduced recently and so far, I did not have time to fix it. Sorry for that. Which CDK version are you using? If 2D layout of SMILES is the only thing you want to achieve, you could try an older release of CDK.
Cheers, Chris allouche miriame wrote: > Is there a way to beautify the 2D structure generated by the SMILES Parser? > I expect to get flat structures but what is displayed is generally > structures with wrong angles or overlapping cycles and bonds. > > Thank you for your help. > > Miriame ALLOUCHE > > _________________________________________________________________ > Windows Live Messenger sur i-mode™ : dialoguez avec vos amis depuis votre > mobile comme sur PC ! http://mobile.live.fr/messenger/bouygues/ > > > ------------------------------------------------------------------------- > This SF.net email is sponsored by: Splunk Inc. > Still grepping through log files to find problems? Stop. > Now Search log events and configuration files using AJAX and a browser. > Download your FREE copy of Splunk now >> http://get.splunk.com/ > _______________________________________________ > Cdk-user mailing list > [email protected] > https://lists.sourceforge.net/lists/listinfo/cdk-user -- PD Dr. Christoph Steinbeck Lecturer in Chemoinformatics Univ. Tuebingen, WSI-RA, Sand 1, D-72076 Tuebingen, Germany Phone: (+49/0) 7071-29-78978 Fax: (+49/0) 7071-29-5091 What is man but that lofty spirit - that sense of enterprise. ... Kirk, "I, Mudd," stardate 4513.3.. ------------------------------------------------------------------------- This SF.net email is sponsored by: Splunk Inc. Still grepping through log files to find problems? Stop. Now Search log events and configuration files using AJAX and a browser. Download your FREE copy of Splunk now >> http://get.splunk.com/ _______________________________________________ Cdk-user mailing list [email protected] https://lists.sourceforge.net/lists/listinfo/cdk-user
