Greg Landrum 6fa65fbc68 move the _VSA descriptors into C++

2011-03-21 05:02:12 +00:00

..

Wrap

move the _VSA descriptors into C++

2011-03-21 05:02:12 +00:00

CMakeLists.txt

move the _VSA descriptors into C++

2011-03-21 05:02:12 +00:00

Crippen.cpp

move lipinski descriptors to C++.

2011-03-14 10:24:42 +00:00

Crippen.h

move lipinski descriptors to C++.

2011-03-14 10:24:42 +00:00

Lipinski.cpp

back out some of the changes from rev1663.

2011-03-16 04:39:07 +00:00

Lipinski.h

back out some of the changes from rev1663.

2011-03-16 04:39:07 +00:00

MolDescriptors.cpp

move lipinski descriptors to C++.

2011-03-14 10:24:42 +00:00

MolDescriptors.h

move lipinski descriptors to C++.

2011-03-14 10:24:42 +00:00

MolSurf.cpp

move the _VSA descriptors into C++

2011-03-21 05:02:12 +00:00

MolSurf.h

move the _VSA descriptors into C++

2011-03-21 05:02:12 +00:00

test_list.py

now all tests pass here as well

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

test.cpp

move the _VSA descriptors into C++

2011-03-21 05:02:12 +00:00