Greg Landrum cb710340a1 Support ETKDG from within the SWIG wrappers (#1010) ...

* add test files

* add seed to the mol name so that it is obvious

* add support (and tests) for ETKDG to Java

2016-08-08 11:08:55 +02:00

..

test_data

Support ETKDG from within the SWIG wrappers (#1010)

2016-08-08 11:08:55 +02:00

Wrap

Dev/cleanup bad confs (#973)

2016-07-25 14:26:19 -04:00

BoundsMatrixBuilder.cpp

remove some duplicated code

2015-12-16 14:36:59 +01:00

BoundsMatrixBuilder.h

first pass, using google style

2015-11-14 14:58:11 +01:00

CMakeLists.txt

add thread libs to a couple of tests

2014-01-25 05:58:51 +00:00

Embedder.cpp

Dev/cleanup bad confs (#973)

2016-07-25 14:26:19 -04:00

Embedder.h

first pass, using google style

2015-11-14 14:58:11 +01:00

test_list.py

now all tests pass here as well

2009-02-03 05:26:10 +00:00

testDgeomHelpers.cpp

Fixes rounding errors in test (#1001)

2016-08-02 06:07:47 +02:00