[Cdk-devel] [ cdk-Patches-3032828 ] Fixed unit test where a SMILES has a zero element??

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Patches item #3032828, was opened at 2010-07-22 00:15
Message generated for change (Tracker Item Submitted) made by egonw
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Category: cdk-1.2.x
Group: Needs Review
Status: Open
Resolution: None
Priority: 5
Private: No
Submitted By: Egon Willighagen (egonw)
Assigned to: Nobody/Anonymous (nobody)
Summary: Fixed unit test where a SMILES has a zero element??

Initial Comment:
At the end of the SMILES was not a carbonyl but a carbon double-bonded to a zero...

I tried git blame, but the file has been moved around, and could not figure out who added that zero...

I am also puzzled why no one every noticed this, as the SMILES parser (well, at least now) fails with an InvalidSMILESException...

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You can respond by visiting: 
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