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New experimental autoimage mode (#1119) CodeQL #262: Commit 77f5392 pushed by drroe
December 6, 2024 20:30 28m 57s master
master
December 6, 2024 20:30 28m 57s
New experimental autoimage mode CodeQL #261: Pull request #1119 opened by drroe
December 6, 2024 19:46 26m 3s drroe:autoimage.byvec
drroe:autoimage.byvec
December 6, 2024 19:46 26m 3s
CodeQL CodeQL #260: Scheduled
December 4, 2024 13:41 28m 56s master
master
December 4, 2024 13:41 28m 56s
Add error message to 'for inmask' when no topology is present (#1116) CodeQL #259: Commit 2aac8b3 pushed by drroe
November 27, 2024 23:14 28m 9s master
master
November 27, 2024 23:14 28m 9s
Add error message to 'for inmask' when no topology is present CodeQL #258: Pull request #1116 opened by drroe
November 27, 2024 21:30 25m 29s drroe:fix.for.inmask
drroe:fix.for.inmask
November 27, 2024 21:30 25m 29s
CodeQL CodeQL #257: Scheduled
November 27, 2024 13:41 29m 4s master
master
November 27, 2024 13:41 29m 4s
CodeQL CodeQL #256: Scheduled
November 20, 2024 13:39 26m 35s master
master
November 20, 2024 13:39 26m 35s
CodeQL CodeQL #255: Scheduled
November 13, 2024 13:36 29m 22s master
master
November 13, 2024 13:36 29m 22s
Allow atommap rmsfit to proceed with partial atom maps CodeQL #254: Pull request #1114 opened by drroe
November 7, 2024 18:43 25m 11s drroe:atommap.changenames2
drroe:atommap.changenames2
November 7, 2024 18:43 25m 11s
CodeQL CodeQL #253: Scheduled
November 6, 2024 13:36 26m 22s master
master
November 6, 2024 13:36 26m 22s
Fix parallel handling of data in repeated trajectory runs for 'rotate… CodeQL #252: Commit 65a2fbe pushed by drroe
November 5, 2024 15:57 28m 55s master
master
November 5, 2024 15:57 28m 55s
Fix parallel handling of data in repeated trajectory runs for 'rotate' and 'average' CodeQL #251: Pull request #1113 opened by drroe
November 5, 2024 14:55 25m 53s drroe:parallel.datafilter
drroe:parallel.datafilter
November 5, 2024 14:55 25m 53s
CodeQL CodeQL #250: Scheduled
October 30, 2024 13:38 26m 31s master
master
October 30, 2024 13:38 26m 31s
Fix handling of generated rotation matrix sets in parallel with the '… CodeQL #249: Commit b41f221 pushed by drroe
October 29, 2024 22:22 28m 52s master
master
October 29, 2024 22:22 28m 52s
Fix handling of generated rotation matrix sets in parallel with the 'rotate' command CodeQL #248: Pull request #1112 opened by drroe
October 29, 2024 20:05 26m 34s drroe:parallel.rotmatrix
drroe:parallel.rotmatrix
October 29, 2024 20:05 26m 34s
CodeQL CodeQL #247: Scheduled
October 23, 2024 13:37 28m 27s master
master
October 23, 2024 13:37 28m 27s
Improve atom mapping between chiral centers (#1111) CodeQL #246: Commit cdf7e30 pushed by drroe
October 22, 2024 15:16 28m 21s master
master
October 22, 2024 15:16 28m 21s
Improve atom mapping between chiral centers CodeQL #245: Pull request #1111 opened by drroe
October 22, 2024 13:58 25m 56s drroe:atommap.chiral
drroe:atommap.chiral
October 22, 2024 13:58 25m 56s
Add energy decomposition (with PME) (#1109) CodeQL #244: Commit addb723 pushed by drroe
October 18, 2024 20:07 29m 8s master
master
October 18, 2024 20:07 29m 8s
Add energy decomposition (with PME) CodeQL #243: Pull request #1109 synchronize by drroe
October 18, 2024 19:10 25m 37s drroe:ene.decomp
drroe:ene.decomp
October 18, 2024 19:10 25m 37s
Add energy decomposition (with PME) CodeQL #242: Pull request #1109 opened by drroe
October 18, 2024 18:44 18m 31s drroe:ene.decomp
drroe:ene.decomp
October 18, 2024 18:44 18m 31s
CodeQL CodeQL #241: Scheduled
October 16, 2024 13:38 26m 36s master
master
October 16, 2024 13:38 26m 36s
CodeQL CodeQL #240: Scheduled
October 9, 2024 13:38 28m 28s master
master
October 9, 2024 13:38 28m 28s
Implement ability to calculate vector magnitude in 'vectormath' comma… CodeQL #239: Commit 8d1a163 pushed by drroe
October 2, 2024 15:30 27m 47s master
master
October 2, 2024 15:30 27m 47s
Implement ability to calculate vector magnitude in 'vectormath' command. CodeQL #238: Pull request #1105 opened by drroe
October 2, 2024 14:32 25m 19s drroe:vectormath.magnitude
drroe:vectormath.magnitude
October 2, 2024 14:32 25m 19s