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Reaction layout exception
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Daniel Lowe
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Jan 25, 2012, 6:21:26 PM
1/25/12
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Indigo indigo = new Indigo();
IndigoObject reaction = indigo.createReaction();
reaction.addProduct(indigo.loadMolecule("CN(S(=O)(=O)C(C(C(C(F)(F)F)
(F)F)(F)F)(F)F)CC1OC1"));
reaction.addReactant(indigo.loadMolecule("ClCC1CO1"));
reaction.layout();
in beta7 generates com.ggasoftware.indigo.IndigoException: array:
invalid index -1 (size=2)
Different but equivalent SMILES for the product do not produce this
bug.
Mikhail Rybalkin
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Jan 29, 2012, 2:35:45 PM
1/29/12
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Hello Daniel,
Thank you the for bug report! In the lastest released version 1.1-
beta8 this bug has been fixed.
Best regards,
Mikhail
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