#1047 Aromaticity detection fails

cdk-1.2.x
closed
5
2012-11-03
2010-03-24
Stefan Kuhn
No

for O=Cc1c(OC)nc2s[cH][cH]n12. A test is in patches.

Discussion

  • Egon Willighagen

    This seems to be caused by the perception of the type of sulphur.

     
  • Egon Willighagen

    It's not the sulphur... it has to do with one ring being aromatic in itself, causing it to not try of both rings are aromatic together...

     
  • Egon Willighagen

    Bug fix patch has been applied.

     

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