Greg Landrum 89398a10c2 make sure computed props get cleared

2013-01-31 04:54:28 +00:00

..

testData

initial support for reading query files. Python wrapper still needs to be done.

2012-12-17 10:28:35 +00:00

ChemTransforms.cpp

backup commit; may not build

2013-01-29 06:28:31 +00:00

ChemTransforms.h

backup commit; may not build

2013-01-29 06:28:31 +00:00

CMakeLists.txt

backup commit; may not build

2013-01-29 06:28:31 +00:00

MolFragmenter.cpp

make sure computed props get cleared

2013-01-31 04:54:28 +00:00

MolFragmenter.h

add fragmentOnBRICSBonds()

2013-01-30 06:31:06 +00:00

test_list.py

now all tests pass here as well

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

testChemTransforms.cpp

make sure computed props get cleared

2013-01-31 04:54:28 +00:00