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758bf8cbce678de0181d180a81dcb4dc2d7dd2df
rdkit
/
Code
/
GraphMol
/
ChemTransforms
History
Ric
58d135a874
Reformat C/C++ code ahead of 2023.03 release (
#6295
)
...
* format files * format template files too
2023-04-28 04:42:35 +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
Reformat C/C++ code ahead of 2023.03 release (
#6295
)
2023-04-28 04:42:35 +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
Fixes
#6034
(
#6035
)
2023-02-02 05:00:47 +01:00
MolFragmenter.h
Reformat C/C++ code ahead of 2023.03 release (
#6295
)
2023-04-28 04:42:35 +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
