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99aa358fe024a7bf198449eadbd7f2e6da3fa433
rdkit/Code/GraphMol/Fingerprints
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Greg Landrum 594c58f86c make the catch tests build faster (#5284) 
* reorg the catch tests
the goal here is to make the builds faster

* make that easier
2022-05-17 04:39:33 +02:00
..
testData
forgot to add the test files
2016-03-15 02:51:20 -07:00
testExecs
Unset executable flag
2019-10-10 20:18:43 +09:00
Wrap
Fixes #4934 (#4940)
2022-01-28 08:09:20 +01:00
AtomPairGenerator.cpp
Add bit information to generalized FP generator (#3858)
2021-03-06 04:25:51 +01:00
AtomPairGenerator.h
Run clang-tidy (modernize-use-override) (#4251)
2021-07-01 05:18:56 +02:00
AtomPairs.cpp
Remove boost::foreach from public headers (#3820)
2021-02-17 14:15:48 +01:00
AtomPairs.h
a few doxygen comment fixes (#4368)
2021-08-09 04:58:01 +02:00
catch_tests.cpp
Fixes #5036 (#5041)
2022-02-23 06:11:40 -05:00
CMakeLists.txt
make the catch tests build faster (#5284)
2022-05-17 04:39:33 +02:00
FingerprintGenerator.cpp
Add bit information to generalized FP generator (#3858)
2021-03-06 04:25:51 +01:00
FingerprintGenerator.h
miscellaneous updates (#4284)
2021-07-13 06:57:29 +02:00
Fingerprints.cpp
Fixes #4212 (#4213)
2021-06-08 09:36:30 -04:00
Fingerprints.h
add support for generating pattern fps for MolBundles (#3665)
2020-12-29 07:33:09 +01:00
FingerprintUtil.cpp
Fixes #5036 (#5041)
2022-02-23 06:11:40 -05:00
FingerprintUtil.h
Run clang-format against header files (#4143)
2021-06-08 07:57:51 +02:00
MACCS.cpp
run clang-tidy with readability-braces-around-statements (#2899)
2020-01-25 14:19:32 +01:00
MACCS.h
clang-tidy-7 pass (#2408)
2019-04-16 12:05:47 -04:00
MHFP.cpp
Run clang-format against cpp (#4358)
2021-10-20 04:25:27 +02:00
MHFP.h
Run clang-format against header files (#4143)
2021-06-08 07:57:51 +02:00
MorganFingerprints.cpp
Swap from RDUNUSED_PARAM to unnamed parameters (#4433)
2021-08-24 17:19:46 -04:00
MorganFingerprints.h
Modernization: use nullptr (#3143)
2020-05-25 09:40:01 +02:00
MorganGenerator.cpp
Add bit information to generalized FP generator (#3858)
2021-03-06 04:25:51 +01:00
MorganGenerator.h
miscellaneous updates (#4284)
2021-07-13 06:57:29 +02:00
PatternFingerprints.cpp
clang-tidy: readability-simplify-boolean-expr (#4639)
2022-03-17 13:50:50 +01:00
RDKitFPGenerator.cpp
Add bit information to generalized FP generator (#3858)
2021-03-06 04:25:51 +01:00
RDKitFPGenerator.h
Run clang-tidy (modernize-use-override) (#4251)
2021-07-01 05:18:56 +02:00
test1.cpp
Remove boost::foreach from public headers (#3820)
2021-02-17 14:15:48 +01:00
testFingerprintGenerators.cpp
Add bit information to generalized FP generator (#3858)
2021-03-06 04:25:51 +01:00
testMHFPFingerprint.cpp
Run clang-format against cpp (#4358)
2021-10-20 04:25:27 +02:00
TopologicalTorsionGenerator.cpp
Add bit information to generalized FP generator (#3858)
2021-03-06 04:25:51 +01:00
TopologicalTorsionGenerator.h
Run clang-tidy (modernize-use-override) (#4251)
2021-07-01 05:18:56 +02:00