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cfe512ea477b1b94128f64913fefa7f9747ddfac
rdkit
/
Code
/
GraphMol
/
ChemTransforms
History
Greg Landrum
1f4584b2ca
run clang_format (
#5676
)
2022-11-01 04:14:26 +01:00
..
testData
initial support for reading query files. Python wrapper still needs to be done.
2012-12-17 10:28:35 +00:00
catch_tests.cpp
run clang_format (
#5676
)
2022-11-01 04:14:26 +01:00
ChemTransforms.cpp
run clang_format (
#5676
)
2022-11-01 04:14:26 +01:00
ChemTransforms.h
a few doxygen comment fixes (
#4368
)
2021-08-09 04:58:01 +02:00
CMakeLists.txt
make the catch tests build faster (
#5284
)
2022-05-17 04:39:33 +02:00
MolFragmenter.cpp
fix warnings (
#5561
)
2022-09-14 06:36:42 +02:00
MolFragmenter.h
MolZip: add atom property labels for mol-zipping (
#5446
)
2022-07-24 06:26:50 +02:00
testChemTransforms.cpp
RGD - a fix for the cubane issue (single target atom matches 2 user R group attachments) (
#4002
)
2021-05-23 15:16:03 -04:00
