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Comment out rdkit in reqs Continuous Integration / Deployment #62: Commit 50e0f36 pushed by jessbade
January 25, 2024 17:46 3m 37s version-change
version-change
January 25, 2024 17:46 3m 37s
Add initial ORCA implementation Continuous Integration / Deployment #61: Commit 77f7231 pushed by smcolby
December 29, 2023 17:29 6m 30s orca
orca
December 29, 2023 17:29 6m 30s
Add etkdg configuration to md Continuous Integration / Deployment #60: Commit a69208e pushed by jessbade
December 4, 2023 06:26 6m 56s rdkitmd
rdkitmd
December 4, 2023 06:26 6m 56s
Version change Continuous Integration / Deployment #59: Pull request #19 synchronize by jessbade
November 2, 2023 21:11 17m 55s version-change
version-change
November 2, 2023 21:11 17m 55s
Rollback python versioning to master, 3.9 Continuous Integration / Deployment #58: Commit dd79e82 pushed by jessbade
November 2, 2023 21:11 4m 30s version-change
version-change
November 2, 2023 21:11 4m 30s
Version change Continuous Integration / Deployment #57: Pull request #19 synchronize by jessbade
November 1, 2023 23:51 4m 47s version-change
version-change
November 1, 2023 23:51 4m 47s
Update rdkit version for bug fix Continuous Integration / Deployment #56: Commit 7ed05af pushed by jessbade
November 1, 2023 23:51 4m 27s version-change
version-change
November 1, 2023 23:51 4m 27s