[Cdk-commits] [cdk/cdk] f6b13d: Added a unit test for the C=[N+]=[N-] functional g...

[<no...@gi...>]

Branch: refs/heads/cdk-1.4.x
Home:   http://github.com/cdk/cdk

Commit: f6b13dcba8782517c070059be2867526250e8375
    http://github.com/cdk/cdk/commit/f6b13dcba8782517c070059be2867526250e8375
Author: Egon Willighagen <eg...@us...>
Date:   2010-10-21 (Thu, 21 Oct 2010)

Changed paths:
  M src/test/org/openscience/cdk/atomtype/CDKAtomTypeMatcherTest.java

Log Message:
-----------
Added a unit test for the C=[N+]=[N-] functional group

Signed-off-by: Rajarshi Guha <raj...@gm...>


Commit: 58a2e0e76adb9de3ae34d0ad9dc6926c2f9b6d28
    http://github.com/cdk/cdk/commit/58a2e0e76adb9de3ae34d0ad9dc6926c2f9b6d28
Author: Egon Willighagen <eg...@us...>
Date:   2010-10-21 (Thu, 21 Oct 2010)

Changed paths:
  M src/main/org/openscience/cdk/atomtype/CDKAtomTypeMatcher.java
  M src/main/org/openscience/cdk/dict/data/cdk-atom-types.owl
  M src/test/org/openscience/cdk/atomtype/CDKAtomTypeMatcherTest.java

Log Message:
-----------
Added missing atom type: positively charged P with three neighbors, of which one double bonded

Signed-off-by: Rajarshi Guha <raj...@gm...>