Files
rdkit/Code/Query/test.cpp
Greg Landrum 1630540ef0 Add cxsmiles query atoms to CTAB parsers and writers (#3261)
* allow CXSMILES generic query atoms to be parsed from mol;
need more tests here

* remove vestigial directory

* Add d_queryType to Query
This opens up additional flexibility with customizing the way queries are handled
Also includes some assorted cleanups in the Query directory

* remove the MolFileSymbol hack added in #3235
We don't need it anymore

* Add support for additional ChemAxon extensions and document them

Signed-off-by: greg landrum <greg.landrum@gmail.com>

* bump pickle version

* add an additional test
2020-07-03 12:51:19 -04:00

6.7 KiB