Files
rdkit/Code/GraphMol/querytest.cpp
Greg Landrum 9991c5247a cleanup of the SMILES/SMARTS parsing and writing code (#2912)
* first cleanup

* next round of changes. all tests pass

* Fixes #2909

* Fixes #2910

* further cleanup

* some cleanup/refactoring of the Dict class

* remove now extraneous calls to hasProp() before clearProp()

* minor refactoring of RDProps.h

* Switch from using our own version of round() to std::round()

* replace some boost::math stuff with the equivalents from std::

* cleanups in SmartsWrite

* refactor out a bunch of duplicated code

* fix an instance of undefined behavior

* changes in response to review
2020-01-29 15:13:39 +01:00

27 KiB