Changed saturation conditional to also check that a bond is not aromatic.

Signed-off-by: Egon Willighagen <egonw@users.sourceforge.net>
Added unit test and annotation for moment generation (3D Similarity)

Signed-off-by: Egon Willighagen <egonw@users.sourceforge.net>
Added missing literature reference, and minimal additional information requested in bug #1285

Change-Id: Id4b46baf50130af657cf1c28cd7ce24b96a240aa
Signed-off-by: John May <john.wilkinsonmay@gmail.com>
Expanded explanation of Sigma Electronegativity Descriptor

Change-Id: Ic37241a6a3d161f873b3d2290c41be7c86ab99c3
Signed-off-by: John May <john.wilkinsonmay@gmail.com>
Now also has a task to create a source distrib that includes the unit tests (per user request)

Change-Id: I6e47a18d2084ce5cf83efc731e2b3db95acbb6b5
Fixed null condition to ensure that null values get pushed back in the array.
replacing full array sort with a range sort
unit tests ensure broken comparators don't put null to the start of the set and than an empty set is never sorted
renamed variable 'minimum' and added explanation as to why it is used.
updated sort to also sort multiplier values - bug:1291
Merge remote branch 'upstream/master'