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Fix for non-deterministic CIP designation bug
build #654: Pull request #1027 opened by tylerperyea
December 5, 2023 12:34 6m 6s tylerperyea:main
December 5, 2023 12:34 6m 6s
Merge pull request #1026 from egonw/updated/deps
build #653: Commit bbe60ce pushed by johnmay
December 4, 2023 17:57 15m 21s main
December 4, 2023 17:57 15m 21s
Updated dependencies
build #652: Pull request #1026 synchronize by egonw
December 2, 2023 12:41 15m 22s egonw:updated/deps
December 2, 2023 12:41 15m 22s
Updated dependencies
build #651: Pull request #1026 opened by egonw
December 1, 2023 20:30 15m 53s egonw:updated/deps
December 1, 2023 20:30 15m 53s
Fixes #1024 - we should perhaps rework the CDK radical representation…
build #650: Commit 3e264a7 pushed by egonw
November 28, 2023 15:36 16m 44s main
November 28, 2023 15:36 16m 44s
Merge pull request #1014 from cdk/Java21
build #648: Commit ab2a931 pushed by johnmay
October 31, 2023 18:18 26m 37s main
October 31, 2023 18:18 26m 37s
Java21
build #647: Pull request #1014 synchronize by johnmay
October 31, 2023 15:07 19m 34s Java21
October 31, 2023 15:07 19m 34s
Fixed the OSGi meta data export
build #646: Pull request #1020 opened by Mailaender
October 17, 2023 15:37 26m 9s Mailaender:osgi
October 17, 2023 15:37 26m 9s
Merge pull request #1019 from egonw/featue/fatalIO
build #645: Commit 8f66145 pushed by johnmay
October 17, 2023 10:24 22m 41s main
October 17, 2023 10:24 22m 41s
Added an API for fatal IO errors
build #644: Pull request #1019 opened by egonw
October 15, 2023 08:33 18m 31s egonw:featue/fatalIO
October 15, 2023 08:33 18m 31s
Code cleanup
build #643: Pull request #1018 opened by egonw
October 15, 2023 07:44 28m 17s egonw:devel/useInterfaces
October 15, 2023 07:44 28m 17s
Fixes https://github.com/cdk/depict/issues/76. We do not like -C=CO a…
build #642: Commit 125505c pushed by egonw
September 29, 2023 12:04 19m 48s main
September 29, 2023 12:04 19m 48s
Fixes https://github.com/cdk/depict/issues/76. We do not like -C=CO a…
build #641: Pull request #1015 opened by johnmay
September 29, 2023 11:35 19m 42s fix/depict-76
September 29, 2023 11:35 19m 42s
Java21
build #640: Pull request #1014 opened by johnmay
September 25, 2023 12:38 30m 24s Java21
September 25, 2023 12:38 30m 24s
Merge pull request #1012 from cdk/mdlv3000-mapidx
build #639: Commit a089e50 pushed by johnmay
September 11, 2023 15:25 13m 47s main
September 11, 2023 15:25 13m 47s
Read the atom-atom mapping info from a V3000 file.
build #638: Pull request #1012 synchronize by johnmay
September 11, 2023 10:17 9m 33s mdlv3000-mapidx
September 11, 2023 10:17 9m 33s
Read the atom-atom mapping info from a V3000 file.
build #637: Pull request #1012 opened by johnmay
September 9, 2023 18:39 9m 19s mdlv3000-mapidx
September 9, 2023 18:39 9m 19s
Log a warning if a query molecule is passed in to the atom-type matcher.
build #636: Commit 4b191ba pushed by egonw
September 8, 2023 07:56 13m 39s main
September 8, 2023 07:56 13m 39s
Fix the CDK C.plus atom type, there was already comment in the test t…
build #635: Commit 8a1fbe1 pushed by egonw
September 5, 2023 11:58 14m 32s main
September 5, 2023 11:58 14m 32s
When atoms/bonds are aware of the container they are in - it is usefu…
build #634: Commit 613b15a pushed by egonw
September 5, 2023 11:57 13m 37s main
September 5, 2023 11:57 13m 37s
Fix the CDK C.plus atom type, there was already comment in the test t…
build #633: Pull request #1011 opened by johnmay
September 5, 2023 09:26 10m 41s C.plus
September 5, 2023 09:26 10m 41s
Add transform/SMIRKS support to CDK.
build #632: Pull request #916 synchronize by johnmay
September 5, 2023 09:24 8m 50s smirks
September 5, 2023 09:24 8m 50s
Add transform/SMIRKS support to CDK.
build #630: Pull request #916 synchronize by johnmay
September 4, 2023 13:45 23s smirks
September 4, 2023 13:45 23s