Greg Landrum e35f7db009 Cleanup/get atoms and bonds (#9243)

2026-04-18 05:22:09 +02:00

..

Wrap

Cleanup/get atoms and bonds (#9243)

2026-04-18 05:22:09 +02:00

CMakeLists.txt

switch to using target_compile_definitions instead of add_definitions (#3350)

2020-08-21 04:49:07 +02:00

GasteigerCharges.cpp

Cleanup/get atoms and bonds (#9243)

2026-04-18 05:22:09 +02:00

GasteigerCharges.h

clang-tidy-7 pass (#2408)

2019-04-16 12:05:47 -04:00

GasteigerParams.cpp

Suppress large amounts of 'BOOST_NO_CXX98_FUNCTION_BASE macro redefined' warnings in clang/emcc builds (#7747)

2025-03-29 20:04:58 +01:00

GasteigerParams.h

Cleanup/get atoms and bonds (#9243)

2026-04-18 05:22:09 +02:00

test1.cpp

Refactor iostreams includes (#8846)

2025-10-08 16:08:01 +02:00