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The Chemistry Development Kit
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Moderate Activity
Commits
: Listings
Analyzed
about 5 hours
ago. based on code collected
about 8 hours
ago.
Nov 11, 2024 — Nov 11, 2025
Showing page 9 of 11
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Merge pull request #1148 from uli-f/gh-workflow-checksum-release-asset
John Mayfield
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10 months ago
add step to print name and url of all assets in GitHub release
Uli
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10 months ago
update cat emoji in workflow step name
Uli
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10 months ago
update comments for clarity and consistency; refine step names in workflow
Uli
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10 months ago
add workflow to compute and upload checksums for release assets
Uli
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10 months ago
Merge pull request #1147 from jscrdev/resolve-sonar-warning
John Mayfield
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10 months ago
Resolved SonarCloud warning
Valentyn Kolesnikov
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10 months ago
Now that AtomContainer cannot have dangling bonds we need to enforce this constraint in the AbstractionSelection utility. There were many places in JChemPaint where we needed to fix the selection to use the already existing 'elements(Class<E>)'
John Mayfield
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10 months ago
When JChemPaint places a phantom spiro atom it doesn't actually add the atoms/bonds so the checks here for laying out inorganic poly-spiro compounds were not quite correct.
John Mayfield
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10 months ago
Merge pull request #1144 from cdk/update/deps-202501
John Mayfield
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10 months ago
Mockito JUnit 5.15
Egon Willighagen
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10 months ago
Assertj 3.27
Egon Willighagen
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10 months ago
CMLXOM 4.10
Egon Willighagen
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10 months ago
Log4j 2.24.3
Egon Willighagen
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10 months ago
Make sure shade doesn't break the cdk-bundle functionality of "include everything"
John Mayfield
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10 months ago
Remove unused imports
John Mayfield
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10 months ago
Require an IChemObjectBuilder to be provided
John Mayfield
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10 months ago
Fix some suggestions from SonarCloud
John Mayfield
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10 months ago
Add the option to locate a IChemObject builder using reflection. Enforce the RDfile reader has one.
John Mayfield
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10 months ago
Next dev version 2.11-SNAPSHOT
John Mayfield
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10 months ago
CDK v2.10
John Mayfield
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10 months ago
Added a new contributor
Egon Willighagen
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10 months ago
Merge pull request #1137 from uli-f/rinchi-logic
John Mayfield
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10 months ago
remove check for RAC1 in stereo element processing
Uli
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10 months ago
update InChIGeneratorTest::andEnantiomer_test to include stereo element generation in strict mode and adjust expected AuxInfo
Uli
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10 months ago
make RInChIDecomposition non-public and non-final; make nested class RInChIDecomposition.Component non-public
Uli
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10 months ago
Merge branch 'main' into rinchi-logic
John Mayfield
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10 months ago
remove misleading comment in InChIGenerator;
Felix Bänsch
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11 months ago
remove dependency-reduced-pom.xml file from the repository
Uli
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11 months ago
update junit-jupiter dependencies to version 5.11.4 (#1139)
Uli
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11 months ago
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