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distopia 0.3.0 compatibility changes
First Time Contributor Greetings #505: Pull request #4734 opened by hmacdope
October 15, 2024 10:24 24s
October 15, 2024 10:24 24s
Add py3.13 support w/ minimal deps
First Time Contributor Greetings #504: Pull request #4732 opened by IAlibay
October 13, 2024 06:28 23s
October 13, 2024 06:28 23s
Fix DeprecationWarning by using np.arctan2 for element-wise array ope…
First Time Contributor Greetings #503: Pull request #4730 opened by laksh-krishna-sharma
October 11, 2024 08:28 27s
October 11, 2024 08:28 27s
'MDAnalysis.analysis.density' parallelization
First Time Contributor Greetings #502: Pull request #4729 opened by talagayev
October 8, 2024 21:17 27s
October 8, 2024 21:17 27s
'MDAnalysis.analysis.nucleicacids' parallelization
First Time Contributor Greetings #501: Pull request #4727 opened by talagayev
October 7, 2024 20:48 23s
October 7, 2024 20:48 23s
[fmt] setup.py and visualization
First Time Contributor Greetings #500: Pull request #4726 opened by RMeli
October 3, 2024 13:22 27s
October 3, 2024 13:22 27s
Add CI step for black (and remove darker)
First Time Contributor Greetings #499: Pull request #4725 opened by RMeli
October 2, 2024 12:39 29s
October 2, 2024 12:39 29s
Bump the github-actions group with 2 updates
First Time Contributor Greetings #498: Pull request #4723 opened by dependabot bot
October 1, 2024 11:40 28s
October 1, 2024 11:40 28s
Implementation of parallelization to MDAnalysis.analysis.dssp
First Time Contributor Greetings #497: Pull request #4721 opened by talagayev
September 27, 2024 23:14 24s
September 27, 2024 23:14 24s
[doc] fix versionchanged display in LAMMPS DumpReader
First Time Contributor Greetings #496: Pull request #4720 opened by orbeckst
September 27, 2024 19:42 29s
September 27, 2024 19:42 29s
fix docs in timestep.pyx
First Time Contributor Greetings #495: Pull request #4719 opened by orbeckst
September 26, 2024 20:59 26s
September 26, 2024 20:59 26s
Implementation of Parallelization to analysis.hydrogenbonds.hbond_analysis
First Time Contributor Greetings #494: Pull request #4718 opened by talagayev
September 25, 2024 09:05 29s
September 25, 2024 09:05 29s
Add black configuration ignoring all files
First Time Contributor Greetings #493: Pull request #4717 opened by RMeli
September 24, 2024 20:50 36s
September 24, 2024 20:50 36s
Dask timeseries prototype
First Time Contributor Greetings #492: Pull request #4714 opened by ljwoods2
September 23, 2024 02:22 28s
September 23, 2024 02:22 28s
[WIP] Implementing gemmi-based mmcif reader (with easy extension to PDB/PDBx and mmJSON)
First Time Contributor Greetings #491: Pull request #4712 opened by marinegor
September 20, 2024 21:57 26s
September 20, 2024 21:57 26s
Adjust num of parts to accomodate number of frames
First Time Contributor Greetings #490: Pull request #4710 opened by yuxuanzhuang
September 20, 2024 06:16 25s
September 20, 2024 06:16 25s
Remove GSD from optional test dependencies
First Time Contributor Greetings #489: Pull request #4707 opened by yuxuanzhuang
September 9, 2024 21:51 26s
September 9, 2024 21:51 26s
Comment out PR trigger on cron CI.
First Time Contributor Greetings #488: Pull request #4705 opened by IAlibay
September 8, 2024 03:10 25s
September 8, 2024 03:10 25s
Hd codes/issue4655
First Time Contributor Greetings #487: Pull request #4702 opened by HD-Codes
September 5, 2024 21:11 49s
September 5, 2024 21:11 49s
Implementation of Parallelization to analysis.gnm
First Time Contributor Greetings #486: Pull request #4700 opened by talagayev
September 2, 2024 09:37 24s
September 2, 2024 09:37 24s
Bump pypa/gh-action-pypi-publish from 1.9.0 to 1.10.0 in the github-actions group
First Time Contributor Greetings #485: Pull request #4699 opened by dependabot bot
September 1, 2024 11:16 23s
September 1, 2024 11:16 23s
IMDv3 Integration
First Time Contributor Greetings #484: Pull request #4694 opened by ljwoods2
August 30, 2024 07:02 26s
August 30, 2024 07:02 26s
Implementation of Parallelization to analysis.bat
First Time Contributor Greetings #483: Pull request #4693 opened by talagayev
August 29, 2024 18:16 26s
August 29, 2024 18:16 26s
Frankenatom fix
First Time Contributor Greetings #482: Pull request #4692 opened by MattTDavies
August 27, 2024 11:28 26s
August 27, 2024 11:28 26s
Debug github runner timeout with tmate
First Time Contributor Greetings #481: Pull request #4691 opened by yuxuanzhuang
August 27, 2024 07:18 26s
August 27, 2024 07:18 26s