[Cdk-commits] [cdk/cdk] 96794e: Resolving regressions in SMSD - it seems to be tha...

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

  Branch: refs/heads/master
  Home:   https://github.com/cdk/cdk
  Commit: 96794e1a720d9582ddb765465ecbe3a4b2fdc96c
      https://github.com/cdk/cdk/commit/96794e1a720d9582ddb765465ecbe3a4b2fdc96c
  Author: John May <joh...@gm...>
  Date:   2013-09-29 (Sun, 29 Sep 2013)

  Changed paths:
    M src/META-INF/test-smsd.libdepends
    M src/main/org/openscience/cdk/smsd/tools/MoleculeSanityCheck.java
    M src/test/org/openscience/cdk/smsd/SMSDTest.java
    M src/test/org/openscience/cdk/smsd/algorithm/mcsplus/MCSPlusHandlerTest.java
    M src/test/org/openscience/cdk/smsd/factory/SubStructureSearchAlgorithmsTest.java

  Log Message:
  -----------
  Resolving regressions in SMSD - it seems to be that the existing code won't match a aromatic double bond with an aromatic single bond (i.e. they both have to be single).

Change-Id: Ib47b2aa3d17649424a53bfeddafa10cee427acca
Signed-off-by: Egon Willighagen <eg...@us...>