Permalink
Commits on Jan 17, 2012
  1. made fingerprint Serializable

    committed Jan 17, 2012
  2. clean up imports

    committed Jan 17, 2012
Commits on Dec 6, 2011
  1. made 0 param constructor public

    committed Dec 6, 2011
Commits on Nov 7, 2011
Commits on Sep 12, 2011
  1. changed to IBitFingerprint

    committed Sep 12, 2011
  2. changed to IBitFingerprint

    committed Sep 12, 2011
  3. fixed wrong index

    committed Aug 22, 2011
  4. fix for tanimoto method 2 + test

    committed Jun 20, 2011
  5. fixed cdk modules and deps

    committed Jun 19, 2011
  6. Added second tanimoto method

    committed Jun 17, 2011
  7. tanimototests

    committed Jun 1, 2011
  8. cardinality should be an int

    committed May 24, 2011
  9. light-weight binary version of signature fp

    based on the new IntArrayFingerprint class which is a sparse representation of a fingerprint only storing the set bits.
    committed May 23, 2011
  10. Introduced IBitFingerprint and ICountFingerprint

    This also includes changing name from getFingerprint to getBitFingerprint on all IFingerprinter
    committed May 23, 2011
  11. Handle a CDKException thrown by the Parser by throwing an IllegalArgu…

    …mentException in the constructor
    
    Signed-off-by: jonalv <jonathan.alvarsson@gmail.com>
    gilleain committed with egonw Sep 12, 2011
  12. Merge branch 'cdk-1.4.x'

    egonw committed Sep 12, 2011
  13. Added two missing tests to overwrite the notifying default implementa…

    …tion
    
    Signed-off-by: maclean <gilleain.torrance@gmail.com>
    egonw committed Sep 12, 2011
  14. Added missing call to super

    Signed-off-by: maclean <gilleain.torrance@gmail.com>
    egonw committed Sep 12, 2011
  15. Fixed getting the isotope count for a particular isotope

    Signed-off-by: maclean <gilleain.torrance@gmail.com>
    egonw committed Sep 12, 2011
Commits on Sep 11, 2011
  1. Ru final

    Signed-off-by: Egon Willighagen <egonw@users.sourceforge.net>
    gilleain committed with egonw Jul 21, 2011
  2. S final

    Signed-off-by: Egon Willighagen <egonw@users.sourceforge.net>
    gilleain committed with egonw Jul 21, 2011
  3. Br final

    Signed-off-by: Egon Willighagen <egonw@users.sourceforge.net>
    gilleain committed with egonw Jul 21, 2011
  4. Zn final

    Signed-off-by: Egon Willighagen <egonw@users.sourceforge.net>
    gilleain committed with egonw Jul 21, 2011
  5. V final

    Signed-off-by: Egon Willighagen <egonw@users.sourceforge.net>
    gilleain committed with egonw Jul 21, 2011