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atom selection/filtering backend refactor Black #209: Pull request #291 opened by ChiCheng45
January 30, 2024 15:21 27s chi/atom-parsing
chi/atom-parsing
January 30, 2024 15:21 27s
renamed method Black #208: Commit 353eb12 pushed by ChiCheng45
January 30, 2024 15:16 26s chi/atom-parsing
chi/atom-parsing
January 30, 2024 15:16 26s
added atom selection by index Black #207: Commit 61c9829 pushed by ChiCheng45
January 30, 2024 13:53 23s chi/atom-parsing
chi/atom-parsing
January 30, 2024 13:53 23s
refactoring Black #206: Commit 11c2e59 pushed by ChiCheng45
January 30, 2024 12:02 30s chi/atom-parsing
chi/atom-parsing
January 30, 2024 12:02 30s
Improve molecule finder Black #205: Pull request #290 opened by MBartkowiakSTFC
January 30, 2024 07:51 21s improve-molecule-finder
improve-molecule-finder
January 30, 2024 07:51 21s
Update converter tests to include compression Black #204: Commit f91813e pushed by MBartkowiakSTFC
January 30, 2024 07:31 21s improve-molecule-finder
improve-molecule-finder
January 30, 2024 07:31 21s
Fix the output trajectory dialog for converters Black #203: Commit db2499d pushed by MBartkowiakSTFC
January 29, 2024 20:59 22s improve-molecule-finder
improve-molecule-finder
January 29, 2024 20:59 22s
updated smarts patterns Black #202: Commit 783e75c pushed by ChiCheng45
January 26, 2024 17:24 23s chi/atom-parsing
chi/atom-parsing
January 26, 2024 17:24 23s
Code cleanup Black #201: Pull request #289 opened by MBartkowiakSTFC
January 26, 2024 14:59 19s code-cleanup
code-cleanup
January 26, 2024 14:59 19s
Correct the code formatting using black Black #200: Commit d78f9c7 pushed by MBartkowiakSTFC
January 26, 2024 14:58 22s code-cleanup
code-cleanup
January 26, 2024 14:58 22s
Remove unused functions Black #199: Commit 727bbb7 pushed by MBartkowiakSTFC
January 26, 2024 14:51 21s code-cleanup
code-cleanup
January 26, 2024 14:51 21s
Artificial trajectory generator Black #198: Pull request #288 opened by MBartkowiakSTFC
January 26, 2024 12:10 24s artificial-trajectory-generator
artificial-trajectory-generator
January 26, 2024 12:10 24s
Correct the formatting using black Black #197: Commit ef40e38 pushed by MBartkowiakSTFC
January 26, 2024 12:07 27s artificial-trajectory-generator
artificial-trajectory-generator
January 26, 2024 12:07 27s
Mdmc mdanse integration Black #196: Pull request #287 opened by MBartkowiakSTFC
January 26, 2024 10:40 21s mdmc-mdanse-integration
mdmc-mdanse-integration
January 26, 2024 10:40 21s
Reformat code using the new black Black #195: Commit 897b369 pushed by MBartkowiakSTFC
January 26, 2024 10:35 22s mdmc-mdanse-integration
mdmc-mdanse-integration
January 26, 2024 10:35 22s
Merge pull request #285 from ISISNeutronMuon/chi/pacf-update Black #194: Commit be69128 pushed by MBartkowiakSTFC
January 26, 2024 09:28 24s protos
protos
January 26, 2024 09:28 24s
reformatted code with black Black #193: Commit 1934a90 pushed by ChiCheng45
January 25, 2024 18:26 21s chi/atom-parsing
chi/atom-parsing
January 25, 2024 18:26 21s
implemented some selection function which use smarts Black #192: Commit e97d3e3 pushed by ChiCheng45
January 25, 2024 18:23 19s chi/atom-parsing
chi/atom-parsing
January 25, 2024 18:23 19s
Create a MockTrajectory object Black #191: Commit 00c0571 pushed by MBartkowiakSTFC
January 25, 2024 13:09 25s artificial-trajectory-generator
artificial-trajectory-generator
January 25, 2024 13:09 25s
chemical entity now creates a rdkit molecule which shadows itself Black #190: Commit 9d07f00 pushed by ChiCheng45
January 25, 2024 11:50 18s chi/atom-selection
chi/atom-selection
January 25, 2024 11:50 18s
chemical entity now creates a rdkit molecule which shadows itself Black #189: Commit 9d07f00 pushed by ChiCheng45
January 25, 2024 11:49 25s chi/atom-parsing
chi/atom-parsing
January 25, 2024 11:49 25s
Change the PACF so it is independent from the origin Black #188: Pull request #285 opened by ChiCheng45
January 24, 2024 17:18 26s chi/pacf-update
chi/pacf-update
January 24, 2024 17:18 26s
change pacf so that it uses positions which are relative to the atoms… Black #187: Commit f520d3a pushed by ChiCheng45
January 24, 2024 17:12 24s chi/pacf-update
chi/pacf-update
January 24, 2024 17:12 24s
Update the tests following the code changes Black #186: Commit e10459b pushed by MBartkowiakSTFC
January 24, 2024 15:52 23s fix-gui-bugs
fix-gui-bugs
January 24, 2024 15:52 23s
Create a prototype TabbedWindow as main widget Black #185: Commit 5e71c62 pushed by MBartkowiakSTFC
January 24, 2024 15:09 22s fix-gui-bugs
fix-gui-bugs
January 24, 2024 15:09 22s