SMILES coordinate generation for 'Ring Test 1' has extra double bonds
Reported by paul (at wingu) | October 27th, 2010 @ 06:14 PM | in 0.2 Complete Basic features
1) select 'Ring Test 1' in layout demo at
kemia/layout/layout_demo.html
2) observe extra double bonds (marked in yellow below)
SMILES O5CCN(CC=3C=1C=CC=CC=1C(=C2C=CC=CC2=3)CN4CCOCC4)CC5
Comments and changes to this ticket
-
Mark Rijnbeek October 28th, 2010 @ 11:03 AM
- State changed from new to resolved
- Assigned user set to Mark Rijnbeek
Coincidentally fixed with git commit 3a7de98c7e3ee0c0510aaf3581359fa9804e88ea
-
paul (at wingu) November 2nd, 2010 @ 07:15 PM
- Milestone changed from 0.3 Enhance features to 0.2 Complete Basic features
- Milestone order changed from 24 to 0
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Javascript Reaction Editor and Cheminformatics Library