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Ensure successful execution through CCS and NMR chemical shifts
Continuous Integration / Deployment #196: Pull request #44 synchronize by smcolby
December 27, 2024 23:49 3m 37s bugfixes
December 27, 2024 23:49 3m 37s
Replace delim_whitespace with `sep="\s+" to resolve deprecation war…
Continuous Integration / Deployment #195: Commit 2bbd527 pushed by smcolby
December 27, 2024 23:49 3m 30s bugfixes
December 27, 2024 23:49 3m 30s
Ensure successful execution through CCS and NMR chemical shifts
Continuous Integration / Deployment #194: Pull request #44 synchronize by smcolby
December 27, 2024 23:38 3m 28s bugfixes
December 27, 2024 23:38 3m 28s
Fix string format
Continuous Integration / Deployment #193: Commit 08301d2 pushed by smcolby
December 27, 2024 23:38 3m 55s bugfixes
December 27, 2024 23:38 3m 55s
Ensure successful execution through CCS and NMR chemical shifts
Continuous Integration / Deployment #192: Pull request #44 synchronize by smcolby
December 27, 2024 22:15 3m 36s bugfixes
December 27, 2024 22:15 3m 36s
Check for property file before parsing shielding
Continuous Integration / Deployment #191: Commit 8fc23b3 pushed by smcolby
December 27, 2024 22:15 3m 28s bugfixes
December 27, 2024 22:15 3m 28s
Ensure successful execution through CCS and NMR chemical shifts
Continuous Integration / Deployment #190: Pull request #44 synchronize by smcolby
December 27, 2024 22:03 3m 26s bugfixes
December 27, 2024 22:03 3m 26s
Parse energy from "out" file, not "property" in ORCA 6
Continuous Integration / Deployment #189: Commit b79e718 pushed by smcolby
December 27, 2024 22:03 3m 35s bugfixes
December 27, 2024 22:03 3m 35s
Ensure successful execution through CCS and NMR chemical shifts
Continuous Integration / Deployment #188: Pull request #44 synchronize by smcolby
December 27, 2024 18:39 3m 28s bugfixes
December 27, 2024 18:39 3m 28s
Exclude directories in finish step
Continuous Integration / Deployment #187: Commit d7aeca3 pushed by smcolby
December 27, 2024 18:39 3m 30s bugfixes
December 27, 2024 18:39 3m 30s
Ensure successful execution through CCS and NMR chemical shifts
Continuous Integration / Deployment #186: Pull request #44 opened by smcolby
December 26, 2024 23:49 3m 53s bugfixes
December 26, 2024 23:49 3m 53s
Fix parsing logic for CREST runs
Continuous Integration / Deployment #185: Commit b3bb053 pushed by smcolby
December 26, 2024 23:48 3m 32s bugfixes
December 26, 2024 23:48 3m 32s
Specify platform-specific build logic
Continuous Integration / Deployment #184: Commit ed893d4 pushed by smcolby
December 19, 2024 19:39 37s v2.0.0-beta
December 19, 2024 19:39 37s
Add folded style for build args
Continuous Integration / Deployment #182: Commit 5140898 pushed by smcolby
December 19, 2024 17:34 50s v2.0.0-beta
December 19, 2024 17:34 50s
Move build args to single line
Continuous Integration / Deployment #175: Commit c85e4e4 pushed by smcolby
December 19, 2024 01:13 3m 53s master
December 19, 2024 01:13 3m 53s
Merge pull request #43 from pnnl/ci-fixes
Continuous Integration / Deployment #171: Commit bfe68e7 pushed by smcolby
December 19, 2024 00:57 3m 55s master
December 19, 2024 00:57 3m 55s
Update continuous integration to use rattler-build
Continuous Integration / Deployment #170: Pull request #43 opened by smcolby
December 19, 2024 00:56 3m 35s ci-fixes
December 19, 2024 00:56 3m 35s
Migrate to rattler-build recipe/actions
Continuous Integration / Deployment #168: Commit 5afdb3b pushed by smcolby
December 19, 2024 00:48 3m 34s ci-fixes
December 19, 2024 00:48 3m 34s
Switch to miniforge3
Continuous Integration / Deployment #167: Commit f0c9d9c pushed by smcolby
December 18, 2024 22:23 8m 30s ci-fixes
December 18, 2024 22:23 8m 30s
Install and switch usage to conda-index
Continuous Integration / Deployment #166: Commit 89cabc4 pushed by jessbade
December 18, 2024 20:25 4m 46s ci-fixes
December 18, 2024 20:25 4m 46s
Merge branch 'ci-fixes'
Continuous Integration / Deployment #165: Commit ba9f129 pushed by smcolby
December 18, 2024 18:38 10m 38s v2.0.0-beta
December 18, 2024 18:38 10m 38s
Merge pull request #42 from pnnl/ci-fixes
Continuous Integration / Deployment #162: Commit e235193 pushed by smcolby
December 18, 2024 17:59 4m 57s master
December 18, 2024 17:59 4m 57s
Update conda recipe and actions for continuous integration
Continuous Integration / Deployment #161: Pull request #42 synchronize by smcolby
December 18, 2024 17:54 4m 2s ci-fixes
December 18, 2024 17:54 4m 2s
Add package import test
Continuous Integration / Deployment #160: Commit cf34f6d pushed by smcolby
December 18, 2024 17:54 4m 6s ci-fixes
December 18, 2024 17:54 4m 6s
Update conda recipe and actions for continuous integration
Continuous Integration / Deployment #159: Pull request #42 opened by smcolby
December 18, 2024 17:51 4m 4s ci-fixes
December 18, 2024 17:51 4m 4s