Re: [Cdk-devel] java.lang.NumberFormatException: For input string: "34000-1"

[Stefan K. <st...@we...>]

Might be. I would ask Matteo once more to provide test case or structure file, 
I will look at it.
Stefan

On Friday 21 March 2008 11:38:57 Nina Jeliazkova wrote:
> This might (or might not ) be related to the unset properties (atomic
> numbers, charges, etc.) and corresponding methods returning null. Java
> 1.5 autoboxing feature makes it hard to be detected in compile time.
>
> I've reported perhaps a similar issue some times ago (no reply though)
>
> http://www.mail-archive.com/cdk...@li.../msg00834.html
>
> Best regards,
> Nina
>
> Matteo Floris написа:
> > Dear all,
> >
> > I have this exception when I try to create some SMILES:
> >
> >
> > Exception in thread "main" java.lang.NumberFormatException: For input
> > string: "34000-1"
> > 	at
> > java
> > .lang.NumberFormatException.forInputString(NumberFormatException.java:
> > 48)
> > 	at java.lang.Long.parseLong(Long.java:412)
> > 	at java.lang.Long.parseLong(Long.java:461)
> > 	at
> > org
> > .openscience
> > .cdk
> > .graph
> > .invariant.CanonicalLabeler.createInvarLabel(CanonicalLabeler.java:140)
> > 	at
> > org
> > .openscience
> > .cdk.graph.invariant.CanonicalLabeler.canonLabel(CanonicalLabeler.java:
> > 81)
> > 	at
> > org
> > .openscience
> > .cdk
> > .smiles
> > .SmilesGenerator
> > .createSMILESWithoutCheckForMultipleMolecules(SmilesGenerator.java:333)
> > 	at
> > org
> > .openscience
> > .cdk.smiles.SmilesGenerator.createSMILES(SmilesGenerator.java:304)
> > 	at
> > org
> > .openscience
> > .cdk.smiles.SmilesGenerator.createSMILES(SmilesGenerator.java:190)
> > 	at Prova.main(Prova.java:436)
> >
> >
> > but I don't understand the possible origin of this problem...
> >
> > Thanks for your help.
> >
> > Regards,
> >
> > Matteo.
> >
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