rdkit

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Files

Greg Landrum 6cfc8f36a7 [WIP] Add Leader picker implementation (#2724 )

* initial commit of Roger's contrib

* add the new file to the headers list

* clang-format

* stub of the python wrapper

* code added for testing

* code added for testing

* add LeaderPicker.seq.h

* default pickSize value

* first crude python wrapper

* Add C++ tests for the LeaderPicker
combine the thread and non-thread versions

* that was not really a test

* support providing a functor from Python

* no longer need the .seq header

* temporarily disable the threaded version to allow CI runs to pass

* some refactoring and cleanup

2019-10-24 13:14:15 +02:00

Wrap

[WIP] Add Leader picker implementation (#2724 )

2019-10-24 13:14:15 +02:00

catch_tests.cpp

[WIP] Add Leader picker implementation (#2724 )

2019-10-24 13:14:15 +02:00

CMakeLists.txt

[WIP] Add Leader picker implementation (#2724 )

2019-10-24 13:14:15 +02:00

DistPicker.cpp

first pass, using google style