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release notes and tag release
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greglandrum committed Jun 10, 2020
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2 changes: 1 addition & 1 deletion CMakeLists.txt
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Expand Up @@ -102,7 +102,7 @@ set(RDK_PYTHON_OUTPUT_DIRECTORY "${CMAKE_CURRENT_BINARY_DIR}/rdkit")
# Config variables:
set(RDKit_Year "2020")
set(RDKit_Month "03")
set(RDKit_Revision "2")
set(RDKit_Revision "3")
set(RDKit_RevisionModifier "")
set(RDKit_ABI "1")

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43 changes: 43 additions & 0 deletions ReleaseNotes.md
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@@ -1,3 +1,46 @@
# Release_2020.03.3
(Changes relative to Release_2020.03.2)

## Acknowledgements:
David Cosgrove, Manan Goel, Jan H. Jensen, Brian Kelley, Matthew Robinson,
Roger Sayle, Ansgar Schuffenhauer, Ivan Tubert-Brohman, Riccardo Vianello,

## Bug Fixes:
- Python tests fail when RDK_BUILD_COMPRESSED_SUPPLIERS is enabled
(github #1888 from greglandrum)
- SGroups with more than one attachment point are now properly parsed
(github #3072 from greglandrum)
- GCC 10.0.1 compile error
(github #3135 from rvianello)
- Error breaking StereoBonds in reactions
(github #3147 from mc-robinson)
- MolOps::removeHs() removes hydrides
(github #3150 from jhjensen2)
- Kekulization error from CreateScaffoldNetwork
(github #3153 from greglandrum)
- Fix drawing of N plus
(github #3165 from DavidACosgrove)
- RWMol::clear() does not explicitly clean up SubstanceGroups or StereoGroups
(github #3167 from greglandrum)
- Modifying a molecule should not automatically clear SubstanceGroups
(github #3168 from greglandrum)
- removeHs() should not remove atoms in SubstanceGroups
(github #3169 from greglandrum)
- fix a memory problem detected in malformed SMILES
(github #3171 from greglandrum)
- Python wrapper: SetQuery and ExpandQuery for bonds
(github #3172 from i-tub)
- S-groups: PARENT field should reference index
(github #3175 from greglandrum)
- rdScaffoldNetwork causes segmenation fault upon None molecule
(github #3177 from AnsgarSchuffenhauer)
- fix a small inconsistency in the name of the inchi package
(github #3182 from rvianello)
- Molecule constructed from CXSMILES cannot be translated to SMARTS
(github #3197 from greglandrum)
- Queries generated from PreprocessReaction cannot be translated to SMARTS
(github #3206 from greglandrum)

# Release_2020.03.2
(Changes relative to Release_2020.03.1)

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