Files
rdkit/Code/JavaWrappers/gmwrapper/src-test
Greg Landrum c988dc4c68 Cleanup some unintended consequences of #2553 (#2735)
* backup

* output bond stereoAtoms in debugMol()

* stop removing STEREOCIS/STEREOTRANS markers in setDoubleBondNeighborDirections()

* Re-establish bond dirs in reaction products.

* test all that
(the first set of tests, should do more)

* cleanups

* add SetDoubleBondNeighborDirections() to python API and test it

* add more tests

* changes in response to review

* add another c++ test, fix the java tests
2019-10-25 04:31:06 +02:00
..