Paolo Tosco adf060c881 - implement #9194 (#9197) ...

- remove redundant #include
- avoid unnecessary copy of match
- expose SubstructMatchParams to JS MinimalLib
- add JS SubstructMatchParams test

Co-authored-by: ptosco <paolo.tosco@novartis.com>

2026-03-26 05:00:42 +01:00

..

testExecs

Unset executable flag

2019-10-10 20:18:43 +09:00

bench.cpp

Refactor iostreams includes (#8846)

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

bond-query.cdxml

Unset executable flag

2019-10-10 20:18:43 +09:00

catch_tests.cpp

simple substructure optimization (#9201)

2026-03-24 15:38:13 +01:00

CMakeLists.txt

Move some more tests over to catch2 (#9058)

2026-01-24 07:03:04 +01:00

cmd_match.cpp

Refactor iostreams includes (#8846)

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

list-query.cdxml

Unset executable flag

2019-10-10 20:18:43 +09:00

regress.txt

Unset executable flag

2019-10-10 20:18:43 +09:00

SubstructMatch.cpp

simple substructure optimization (#9201)

2026-03-24 15:38:13 +01:00

SubstructMatch.h

Allow adding custom atom and bond matcher functions for substructure searching (#8994)

2025-12-12 20:03:31 +01:00

SubstructUtils.cpp

- implement #9194 (#9197)

2026-03-26 05:00:42 +01:00

SubstructUtils.h

Modernization of some substructure code (#8450)

2025-05-12 06:33:25 +02:00

testSubstructMatch.cpp

Leak fixes for 2026.03.1 (#9198)

2026-03-25 05:56:26 +01:00

ullmann.hpp

style: apply readability-braces-around-statements (#8136)

2026-02-09 12:10:50 +01:00

UnitTestSubstruct.py

Reformat Python code for 2023.03 release (#6294)

2023-04-28 06:53:56 +02:00

vf2.hpp

Fixes #7685 (#7864)

2024-09-29 05:23:24 +02:00