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19fc030f704bebecd2dffbf8f079dc44b524ce0a
rdkit
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Code
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DataManip
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MetricMatrixCalc
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Greg Landrum
79e1f8b1fa
compiles without numpy warnings, all tests pass on ubuntu 15.04 with numpy 1.10
2015-11-28 06:49:34 +01:00
..
testExecs
initial import
2006-05-06 22:20:08 +00:00
Wrap
compiles without numpy warnings, all tests pass on ubuntu 15.04 with numpy 1.10
2015-11-28 06:49:34 +01:00
CMakeLists.txt
merge in a set of changes from Riccardo V. to install .h files as well;
2010-09-04 14:07:22 +00:00
MetricFuncs.h
first pass, using google style
2015-11-14 14:58:11 +01:00
MetricMatrixCalc.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
testMatCalc.cpp
first pass, using google style
2015-11-14 14:58:11 +01:00