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7065810cfdfd66c07cb5ca7036986d8662ef1ebd
rdkit
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Code
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DataManip
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MetricMatrixCalc
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Greg Landrum
9727cffa61
make python wrappers and tests optional
2010-01-22 11:22:58 +00:00
..
testExecs
initial import
2006-05-06 22:20:08 +00:00
Wrap
make python wrappers and tests optional
2010-01-22 11:22:58 +00:00
CMakeLists.txt
builds and passes tests on linux
2009-09-28 11:02:18 +00:00
Jamfile
this is probably a ways from done, but now at least we can run bjam under mingw without it immediately erroring out
2008-11-15 17:14:13 +00:00
MetricFuncs.h
remove vflib from Jamfiles
2009-06-29 11:47:38 +00:00
MetricMatrixCalc.h
mostly refactoring. NOTE: This may not build as is.
2007-11-09 17:31:45 +00:00
test_list.py
now all tests pass here as well
2009-02-03 05:26:10 +00:00
testMatCalc.cpp
mostly refactoring. NOTE: This may not build as is.
2007-11-09 17:31:45 +00:00