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rdkit/Code/GraphMol/SubstructLibrary
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Brian Kelley 4c0a99f2ad Add multithreaded pattern/fp generator (#2973) 
* Add threaded pattern generator to help speed up library creation

* Add size to FPHolderBase

* Add more complete python wrapper, fix leak in doctest

* Add basic usage test for addPatterns, fix I/O leak

* Add basic test for trusted smiles

* Actually add the new code

* Export addPatterns on windows

* Try fixing the cartridge build

* Change pattern_factory to PatternFactory

* Change boost::ref to std::ref
2020-03-04 09:41:03 -05:00
..
Wrap
Add multithreaded pattern/fp generator (#2973)
2020-03-04 09:41:03 -05:00
CMakeLists.txt
Add multithreaded pattern/fp generator (#2973)
2020-03-04 09:41:03 -05:00
PatternFactory.cpp
Add multithreaded pattern/fp generator (#2973)
2020-03-04 09:41:03 -05:00
PatternFactory.h
Add multithreaded pattern/fp generator (#2973)
2020-03-04 09:41:03 -05:00
SubstructLibrary.cpp
run clang-tidy with readability-braces-around-statements (#2899)
2020-01-25 14:19:32 +01:00
SubstructLibrary.h
Add multithreaded pattern/fp generator (#2973)
2020-03-04 09:41:03 -05:00
SubstructLibrarySerialization.h
clang-tidy-7 pass (#2408)
2019-04-16 12:05:47 -04:00
substructLibraryTest.cpp
Add multithreaded pattern/fp generator (#2973)
2020-03-04 09:41:03 -05:00