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e4f4644a89d6446ddebda0bf396fa4335324c41c
rdkit/Code/GraphMol/MolInterchange
History
Paolo Tosco b5d4b54d20 - patch RapidJSON 1.1.0 release backporting a fix from the master branch to avoid a compilation error on newer compilers (fix #7485) (#7550)
- update MinimalLib Dockerfile to Debian Bookworm and patch RapidJSON in case someone wants to build an older release (fix #7530)

Co-authored-by: ptosco <paolo.tosco@novartis.com>
2024-06-23 06:59:52 +02:00
..
test_data
Support for a JSON-based molecule interchange format (#1798)
2018-04-02 05:12:03 +02:00
Wrap
Reformat Python code for 2023.03 release (#6294)
2023-04-28 06:53:56 +02:00
CMakeLists.txt
- patch RapidJSON 1.1.0 release backporting a fix from the master branch to avoid a compilation error on newer compilers (fix #7485) (#7550)
2024-06-23 06:59:52 +02:00
details.h
Change IUPAC metal->non-metal single bonds to dative (#6038)
2023-02-06 04:37:32 +01:00
molinterchange_catch.cpp
Fixes #5923 (#7039)
2024-01-19 18:43:30 +01:00
MolInterchange.h
Reformat C/C++ code ahead of 2023.03 release (#6295)
2023-04-28 04:42:35 +02:00
Parser.cpp
atropisomer handling added (#6903)
2023-12-22 04:58:18 +01:00
test1.cpp
Support SubstanceGroups and StereoGroups in JSON (#5909)
2023-01-04 16:29:36 +01:00
Writer.cpp
atropisomer handling added (#6903)
2023-12-22 04:58:18 +01:00
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