Greg Landrum dde589955e fix FreeChemicalFeatures pickling and some syntax problems in testFeatures.py

2014-06-24 05:24:28 +02:00

..

Catalogs

more on #204

2014-02-06 06:43:28 +01:00

ChemicalFeatures

fix FreeChemicalFeatures pickling and some syntax problems in testFeatures.py

2014-06-24 05:24:28 +02:00

cmake/Modules

support running tests when building inside the source tree on windows

2014-04-12 15:24:29 +02:00

DataManip

initial set of changes introducing python3 support

2014-06-17 18:26:41 +02:00

DataStructs

undo a couple un-necessary changes and, hopefully, get this working with python2 again

2014-06-21 04:48:48 +02:00

Demos

boost_system not required

2014-01-04 16:48:57 +01:00

DistGeom

initial set of changes introducing python3 support

2014-06-17 18:26:41 +02:00

doxygen

update doxygen files and add new logo without text

2013-07-11 07:19:33 +02:00

Features

add missing headers for "make install"

2013-02-05 04:57:59 +00:00

ForceField

initial set of changes introducing python3 support

2014-06-17 18:26:41 +02:00

Geometry

more pickle cleanups

2014-06-20 06:59:11 +02:00

GraphMol

another python3 test failure fixed

2014-06-24 05:14:52 +02:00

JavaWrappers

Fixes #270

2014-05-24 06:16:52 +02:00

ML

initial set of changes introducing python3 support

2014-06-17 18:26:41 +02:00

Numerics

initial set of changes introducing python3 support

2014-06-17 18:26:41 +02:00

PgSQL/rdkit

add tests for indexing on maccs

2014-05-09 18:17:27 +02:00

Query

add getFullDescription() to Query;

2014-05-22 15:18:07 +02:00

RDBoost

initial set of changes introducing python3 support

2014-06-17 18:26:41 +02:00

RDGeneral

some cleanups areound the Invariant code

2014-01-01 16:39:53 +01:00

SimDivPickers

initial set of changes introducing python3 support

2014-06-17 18:26:41 +02:00

CMakeLists.txt

add missing headers for "make install"

2013-02-05 04:57:59 +00:00

notes.txt

initial import

2006-05-06 22:20:08 +00:00

test_list.py

get geometry tests working on mac and include them in the default build

2009-10-02 10:12:46 +00:00