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rdkit/Code/GraphMol/ChemTransforms
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Ricardo Rodriguez d90a73aa6b Leak fixes for 2026.03.1 (#9198) 
* fix mols leaked in tests

* own invariant generators

* clean up MorganFeatureAtomInvGenerator patterns

* address review suggestions
2026-03-25 05:56:26 +01:00
..
testData
initial support for reading query files. Python wrapper still needs to be done.
2012-12-17 10:28:35 +00:00
catch_tests.cpp
Leak fixes for 2026.03.1 (#9198)
2026-03-25 05:56:26 +01:00
ChemTransforms.cpp
propagate string_view (#8858)
2025-10-14 19:15:37 +02:00
ChemTransforms.h
propagate string_view (#8858)
2025-10-14 19:15:37 +02:00
CMakeLists.txt
move molzip to its own file (#9013)
2025-12-22 10:42:23 -05:00
MolFragmenter.cpp
move molzip to its own file (#9013)
2025-12-22 10:42:23 -05:00
MolFragmenter.h
Allow molzip to position fragments when joining them (#9021)
2026-01-07 10:33:03 -05:00
MolFragmenterJSONParser.cpp
Allow molzip to position fragments when joining them (#9021)
2026-01-07 10:33:03 -05:00
MolFragmenterJSONParser.h
Expose molzip functionality to MinimalLib (#7959)
2024-11-12 17:16:14 +01:00
MolZip.cpp
Allow molzip to position fragments when joining them (#9021)
2026-01-07 10:33:03 -05:00
testChemTransforms.cpp
Refactor iostreams includes (#8846)
2025-10-08 16:08:01 +02:00