Paolo Tosco f642667686 avoid passing a NULL pointer to CanSmiles (which will happen if there are not atoms in the molblock and hence a NULL SMILES) as undefined behavior will arise (#5750) ...

Co-authored-by: Tosco, Paolo <paolo.tosco@novartis.com>

2022-11-14 15:37:44 +01:00

..

AvalonTools

avoid passing a NULL pointer to CanSmiles (which will happen if there are not atoms in the molblock and hence a NULL SMILES) as undefined behavior will arise (#5750)

2022-11-14 15:37:44 +01:00

catch

fixes #5089 (#5092)

2022-03-14 04:42:17 +01:00

CoordGen

Fix downcast (#5479)

2022-08-03 04:58:34 +02:00

Eigen

Add Eigen to ExternalProject and automatically download if RDK_BUILD_DESCRIPTORS3D (#3075)

2021-09-30 16:45:01 +02:00

FreeSASA

Fix Flake8 erorrs (#4252)

2022-03-10 06:55:18 +01:00

GA

clang-tidy: readability-simplify-boolean-expr (#4639)

2022-03-17 13:50:50 +01:00

INCHI-API

fix + test (#5057)

2022-03-05 04:32:31 +01:00

pymol/modules/pymol

Tidy Up (#2834)

2019-12-18 16:44:55 +01:00

RingFamilies

- enable using the URF library in Windows static builds (#4357)

2021-07-27 21:47:44 +02:00

YAeHMOP

Switch yaehmop wrapper to basic cmake (#5558)

2022-09-14 04:44:55 +02:00

CMakeLists.txt

R group symmetry (#3565)

2021-01-05 09:27:33 -05:00