Brian Kelley cad6962a37 Adds linker style zipping (#8289) ...

* Adds linker style zipping

* Fix dangling dummy atoms, i.e. [*:1].C

* Run clang-format

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Co-authored-by: Brian Kelley <bkelley@glysade.com>

2025-03-06 05:44:25 +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

Adds linker style zipping (#8289)

2025-03-06 05:44:25 +01:00

ChemTransforms.cpp

Run clang-format across everything (#7849)

2024-09-26 13:39:02 +02:00

ChemTransforms.h

RGD and Stereo Groups (#6247)

2023-04-01 07:58:52 +02:00

CMakeLists.txt

Expose molzip functionality to MinimalLib (#7959)

2024-11-12 17:16:14 +01:00

MolFragmenter.cpp

Adds linker style zipping (#8289)

2025-03-06 05:44:25 +01:00

MolFragmenter.h

Expose molzip functionality to MinimalLib (#7959)

2024-11-12 17:16:14 +01:00

MolFragmenterJSONParser.cpp

Expose molzip functionality to MinimalLib (#7959)

2024-11-12 17:16:14 +01:00

MolFragmenterJSONParser.h

Expose molzip functionality to MinimalLib (#7959)

2024-11-12 17:16:14 +01:00

testChemTransforms.cpp

remove no-op macros and dead code (pt 2) (#8035)

2025-01-11 14:10:00 +01:00