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08cc96336c2ae54405232dd80c9efecfea5fbd28
rdkit
/
Code
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GraphMol
/
ChemTransforms
History
Gareth Jones
81e9cb2386
Fix stereo bond corruption on RGD. (
#6832
)
2023-10-28 12:47:58 +02:00
..
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
Reformat C/C++ code ahead of 2023.03 release (
#6295
)
2023-04-28 04:42:35 +02:00
ChemTransforms.cpp
Fix stereo bond corruption on RGD. (
#6832
)
2023-10-28 12:47:58 +02:00
ChemTransforms.h
RGD and Stereo Groups (
#6247
)
2023-04-01 07:58:52 +02:00
CMakeLists.txt
Add depiction coordinates to molzip (
#5993
)
2023-01-28 04:46:39 +01:00
MolFragmenter.cpp
Fail CI builds on compiler warnings + some fixes (
#6675
)
2023-09-02 04:38:45 +02:00
MolFragmenter.h
Reformat C/C++ code ahead of 2023.03 release (
#6295
)
2023-04-28 04:42:35 +02:00
testChemTransforms.cpp
Fix some build warnings (
#6618
)
2023-08-11 06:04:55 +02:00
