User Activity

  • Created ticket #110 on Scaffold Hunter

    Ertl algorithm for functional groups

  • Created ticket #108 on Scaffold Hunter

    Show subset comments in Table

  • Created ticket #107 on Scaffold Hunter

    Calc plugins

  • Posted a comment on ticket #275 on Scaffold Hunter

    With a similar, large sdf file I receive a bunch of errors, starting with a CDKexception for smiles generation and ending with an UTF8 issue Jun 01, 2017 3:21:53 PM edu.udo.scaffoldhunter.model.util.CanonicalSmilesGenerator createSMILES SCHWERWIEGEND: Smiles generation failed org.openscience.cdk.exception.CDKException: Unsupported bond order: UNSET at org.openscience.cdk.smiles.CDKToBeam.toBeamEdgeLabel(CDKToBeam.java:270) at org.openscience.cdk.smiles.CDKToBeam.toBeamEdge(CDKToBeam.java:240) at...

  • Posted a comment on ticket #101 on Scaffold Hunter

    Is that structure hiding only for export or is it of interest to fix the semantix...

  • Modified ticket #197 on Scaffold Hunter

    Inactive cloud options partly visible

  • Modified ticket #199 on Scaffold Hunter

    Subset contains no scaffolds error

  • Created ticket #251 on Scaffold Hunter

    Scaffold Tree level expansion bug

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Username:
kakl
Joined:
2009-05-06 15:15:36

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