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Added a regression test
Test #197: Commit ae2a525 pushed by drmeister
November 29, 2023 21:17 27m 50s main
November 29, 2023 21:17 27m 50s
Added missing files
Test #196: Commit 8bce45e pushed by drmeister
November 29, 2023 18:19 40m 51s main
November 29, 2023 18:19 40m 51s
Add an activeAtomMask argument to functions
Test #195: Commit 883cc47 pushed by drmeister
November 29, 2023 18:14 5m 32s main
November 29, 2023 18:14 5m 32s
Lots of changes to support proteins+spiroligomers
Test #194: Commit 91c54e1 pushed by drmeister
November 20, 2023 20:01 56m 14s main
November 20, 2023 20:01 56m 14s
Add pick-list
Test #193: Commit fa0fe4e pushed by yitzchak
November 18, 2023 14:49 54m 11s main
November 18, 2023 14:49 54m 11s
Fix a few warnings
Test #192: Commit a13423c pushed by drmeister
November 5, 2023 16:34 1h 15m 18s main
November 5, 2023 16:34 1h 15m 18s
Cleaned up -Wmismatched-tags warnings
Test #191: Commit 4fa656c pushed by drmeister
November 4, 2023 18:18 57m 22s main
November 4, 2023 18:18 57m 22s
Fixed all out of order initializers
Test #190: Commit 5dcb408 pushed by drmeister
November 4, 2023 16:45 1h 28m 4s main
November 4, 2023 16:45 1h 28m 4s
Add scando-user-install
Test #189: Commit 8da84b2 pushed by yitzchak
November 3, 2023 20:10 1h 31m 59s main
November 3, 2023 20:10 1h 31m 59s
Update cando-user-install
Test #188: Commit 20d67c2 pushed by yitzchak
November 2, 2023 10:06 1h 27m 12s main
November 2, 2023 10:06 1h 27m 12s
Merge branch 'apptainer'
Test #187: Commit 29ff1bd pushed by yitzchak
November 1, 2023 17:25 1h 32m 40s main
November 1, 2023 17:25 1h 32m 40s
More kinematics and topology impovements
Test #186: Commit 89de55a pushed by drmeister
November 1, 2023 17:23 1h 43m 31s main
November 1, 2023 17:23 1h 43m 31s
Add support for new topology code
Test #185: Commit 941bf6a pushed by drmeister
October 16, 2023 02:36 1h 43m 35s main
October 16, 2023 02:36 1h 43m 35s
Changes to support correcting geometry
Test #184: Commit 3d4a3fc pushed by drmeister
September 30, 2023 18:39 5m 18s main
September 30, 2023 18:39 5m 18s
Add monomer-context to fragment-internals
Test #183: Commit 66d2f65 pushed by drmeister
September 24, 2023 15:19 5h 34m 47s main
September 24, 2023 15:19 5h 34m 47s
Improve the topology package
Test #182: Commit 42899a1 pushed by drmeister
September 23, 2023 02:45 1h 59m 17s main
September 23, 2023 02:45 1h 59m 17s
Improve clustering in topology
Test #181: Commit a9e83b3 pushed by drmeister
September 18, 2023 15:57 1h 51m 30s main
September 18, 2023 15:57 1h 51m 30s
Improve connecting rotamers
Test #180: Commit 25e0ad9 pushed by drmeister
September 15, 2023 17:03 1h 52m 36s main
September 15, 2023 17:03 1h 52m 36s
Merge pull request #63 from cando-developers/dependabot/github_action…
Test #179: Commit 2ba68d2 pushed by yitzchak
September 11, 2023 14:24 1h 49m 5s main
September 11, 2023 14:24 1h 49m 5s
Added missing base class
Test #177: Commit 67b8129 pushed by drmeister
September 10, 2023 17:11 1h 43m 53s main
September 10, 2023 17:11 1h 43m 53s
Lots of changes to support phi/psi keys
Test #176: Commit de2595f pushed by drmeister
September 9, 2023 22:17 1h 49m 12s main
September 9, 2023 22:17 1h 49m 12s
Improve connecting rotamers
Test #175: Commit 4b6cab3 pushed by drmeister
August 28, 2023 21:00 2h 3m 27s main
August 28, 2023 21:00 2h 3m 27s
Add vectorized Distance2 function
Test #174: Commit b520d0f pushed by drmeister
August 28, 2023 20:58 2h 1m 24s main
August 28, 2023 20:58 2h 1m 24s
Add a sample-aggregate function
Test #173: Commit dddddb3 pushed by drmeister
August 15, 2023 20:00 2h 25m 42s main
August 15, 2023 20:00 2h 25m 42s