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2920a840c3547736cc64d7b6971094de85bb6581
rdkit
/
Code
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GraphMol
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ChemTransforms
History
Nadine Schneider
5d963846b8
merge
2015-04-10 09:44:18 +02:00
..
testData
initial support for reading query files. Python wrapper still needs to be done.
2012-12-17 10:28:35 +00:00
ChemTransforms.cpp
Code/RDBoost/Exceptions.h moved to Code/RDGeneral
2015-03-16 22:31:48 +01:00
ChemTransforms.h
improve docs;
2014-05-03 06:45:35 +02:00
CMakeLists.txt
do not include _static versions for test links. This breaks on windows
2013-03-22 05:18:35 +00:00
MolFragmenter.cpp
Code/RDBoost/Exceptions.h moved to Code/RDGeneral
2015-03-16 22:31:48 +01:00
MolFragmenter.h
did not have the version for breakSomeBonds() quite right
2014-11-22 10:42:17 +01:00
test_list.py
now all tests pass here as well
2009-02-03 05:26:10 +00:00
testChemTransforms.cpp
merge
2015-04-10 09:44:18 +02:00