Re: [Joelib-help] draw molecule

[Joerg K. W. <we...@in...>]

Hi Andreas,

please try
joelib.gui.render.MoleculeViewer2D

Have a look at the main method and for details:
display(JOEMol molecule, String _title,
         JOESmartsPattern smarts, String eTransfer, String retroSynth,
         String conjRing, String labels)

You know that this can be only used for the visulization. There is no 
editor functionality available as in CDK.
The sources here are adapted CDK sources, so it should not be to much 
effort, but ... as allways time is rare to combine all functionality at 
once.
So, a basic event model is still available, which is simply not activated.

If you use CDK parts do not forget to mention the license from them ! 
Because open source developers work more or less only for reading their 
names in the sources, so they will be really upset if we forget these 
things. I know this, i've once a time forgotten the correct license, by 
replacing the header with copy-and-paste.

Kind regards, Joerg

-- 
Dipl. Chem. Joerg K. Wegner
Center of Bioinformatics Tuebingen (ZBIT)
Department of Computer Architecture
Univ. Tuebingen, Sand 1, D-72076 Tuebingen, Germany
Phone: (+49/0) 7071 29 78970
Fax: (+49/0) 7071 29 5091
E-Mail: mailto:we...@in...
WWW:    http://www-ra.informatik.uni-tuebingen.de
--
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                                     (E. Hemingway)

Never mistake action for meaningful action.
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