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Added a module for working with RMG reaction families
CodeQL #1211: Pull request #754 synchronize by alongd
December 7, 2024 18:10 2m 29s reaction_families
December 7, 2024 18:10 2m 29s
Added a module for working with RMG reaction families
CI #6248: Pull request #754 synchronize by alongd
December 7, 2024 18:10 In progress reaction_families
December 7, 2024 18:10 In progress
Added a module for working with RMG reaction families
Labeler #1556: Pull request #754 synchronize by alongd
December 7, 2024 18:10 17s reaction_families
December 7, 2024 18:10 17s
Added a module for working with RMG reaction families
CodeQL #1210: Pull request #754 synchronize by alongd
December 7, 2024 17:34 2m 23s reaction_families
December 7, 2024 17:34 2m 23s
Added a module for working with RMG reaction families
CI #6246: Pull request #754 synchronize by alongd
December 7, 2024 17:34 28m 15s reaction_families
December 7, 2024 17:34 28m 15s
Added a module for working with RMG reaction families
Labeler #1555: Pull request #754 synchronize by alongd
December 7, 2024 17:34 11s reaction_families
December 7, 2024 17:34 11s
f family module
CI #6245: Commit 5d05903 pushed by alongd
December 7, 2024 17:34 27m 42s reaction_families
December 7, 2024 17:34 27m 42s
Added a module for working with RMG reaction families
CI #6244: Pull request #754 synchronize by alongd
December 7, 2024 17:33 27m 53s reaction_families
December 7, 2024 17:33 27m 53s
Added a module for working with RMG reaction families
Labeler #1554: Pull request #754 synchronize by alongd
December 7, 2024 17:33 15s reaction_families
December 7, 2024 17:33 15s
Added a module for working with RMG reaction families
CodeQL #1209: Pull request #754 synchronize by alongd
December 7, 2024 17:33 2m 30s reaction_families
December 7, 2024 17:33 2m 30s
f reaction fam import
CI #6243: Commit 828dadd pushed by alongd
December 7, 2024 17:33 28m 49s reaction_families
December 7, 2024 17:33 28m 49s
CI
CI #6242: Scheduled
December 7, 2024 01:10 2h 2m 49s main
December 7, 2024 01:10 2h 2m 49s
Adapt parse_nd_scan_energies() to a slightly different Gaussian 2D scan format
CodeQL #1208: Pull request #777 opened by alongd
December 6, 2024 06:44 2m 25s 2dsfix
December 6, 2024 06:44 2m 25s
Adapt parse_nd_scan_energies() to a slightly different Gaussian 2D scan format
CI #6241: Pull request #777 opened by alongd
December 6, 2024 06:44 2h 2m 51s 2dsfix
December 6, 2024 06:44 2h 2m 51s
Adapt parse_nd_scan_energies() to a slightly different Gaussian 2D scan format
Labeler #1553: Pull request #777 opened by alongd
December 6, 2024 06:44 15s 2dsfix
December 6, 2024 06:44 15s
Adapt parse_nd_scan_energies() to a slightly different Gaussian 2D scan format
CI #6240: Pull request #777 review_requested by alongd
December 6, 2024 06:44 2h 4m 57s 2dsfix
December 6, 2024 06:44 2h 4m 57s
Tests: Another format of a 2D scan
CI #6239: Commit 8d1301e pushed by alongd
December 6, 2024 06:43 2h 1m 21s 2dsfix
December 6, 2024 06:43 2h 1m 21s
CI
CI #6238: Scheduled
December 6, 2024 01:10 2h 9m 14s main
December 6, 2024 01:10 2h 9m 14s
CI
CI #6237: Scheduled
December 5, 2024 01:11 2h 5m 2s main
December 5, 2024 01:11 2h 5m 2s
temp
CI #6236: Commit 1e96bd6 pushed by JintaoWu98
December 5, 2024 00:51 46m 8s puckering_z_coord
December 5, 2024 00:51 46m 8s
CI
CI #6235: Scheduled
December 4, 2024 01:12 2h 7m 48s main
December 4, 2024 01:12 2h 7m 48s
Merge remote-tracking branch 'origin/nmd' into debug_statement
CI #6234: Commit f5b373d pushed by calvinp0
December 3, 2024 08:55 2h 6m 30s debug_statement
December 3, 2024 08:55 2h 6m 30s
remove hydrogen, add intermediate drawing
CI #6233: Commit f14c6e8 pushed by JintaoWu98
December 3, 2024 08:21 52m 2s puckering_z_coord
December 3, 2024 08:21 52m 2s
Changes of default_levels_of theory
CI #6232: Commit 1dee7d9 pushed by JintaoWu98
December 3, 2024 08:19 2h 3m 4s default_confsp_LOT
December 3, 2024 08:19 2h 3m 4s