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base repository: cdk/cdk
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head repository: cdk/cdk
compare: 1e0cfdb2a086
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  • 2 commits
  • 1 file changed
  • 2 contributors

Commits on Aug 5, 2013

  1. When a reaction references a molecule which is unknown - automaticall…

    …y create one with that Id. This happens when the set of molecules is defined after the reaction. This commit resolve the test in error 'CML2Test. testBug2697568'
    
    Signed-off-by: Egon Willighagen <egonw@users.sourceforge.net>
    johnmay authored and egonw committed Aug 5, 2013
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  2. Backport for cdk-1.4.x: use IMolecule in IMoleculeSet

    Change-Id: I110f4bc5078de535f8840eae811ad69752503b39
    egonw committed Aug 5, 2013
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