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Refactoring the logging module readthedocs/preview #568: Pull request #5367 opened by jauy123
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Changed definition of self._groupselections_ref_coords64 readthedocs/preview #567: Pull request #5366 opened by DhanushkaWeerakoon
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FIX: Full resname matching for nucleic acid analysis readthedocs/preview #566: Pull request #5365 opened by BradyAJohnston
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Performance: significant speedup and memory usage improvement for PCA().run() readthedocs/preview #565: Pull request #5352 opened by jberg5
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Standardize atomicdistances to use results readthedocs/preview #564: Pull request #5347 opened by charity-g
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Add ASV benchmark suite and vectorized distance optimization readthedocs/preview #563: Pull request #5346 opened by Zzeelan7
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FIX: Use mean aggregation for InterRDF bins readthedocs/preview #562: Pull request #5344 opened by raulloiscuns
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Fix bond guessing with mixed-case atomtypes readthedocs/preview #561: Pull request #5343 opened by hejamu
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Add input validation and tests for contact_matrix readthedocs/preview #560: Pull request #5339 opened by PulindGadhia
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Add support for wrapping representations (tric, rect, compact) in AtomGroup.wrap() readthedocs/preview #559: Pull request #5338 opened by ayushk687
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feat: implement from_AlphaFold fetcher #3377 readthedocs/preview #558: Pull request #5335 opened by jhawpetoss6-collab
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FIX (CI): Update First Contributor Greeting workflow inputs and add issue_message readthedocs/preview #557: Pull request #5332 opened by ParthUppal523
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DOC: (Follow-up to PR #5325) Add missing docstrings and update CHANGELOG readthedocs/preview #556: Pull request #5331 opened by ParthUppal523
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tests: replaced deprecated assert_almost_equal in GNM analysis test ref #3743 readthedocs/preview #555: Pull request #5329 opened by MegaCoderNerd
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Add documentation for 'all' selection keyword readthedocs/preview #554: Pull request #5326 opened by RitikaSen27
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DOC: add documentation for 'all' keyword readthedocs/preview #553: Pull request #5325 opened by ParthUppal523
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Fix incorrect inputs in first-interaction GitHub Action workflow readthedocs/preview #552: Pull request #5324 opened by Ananya-vit
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Improve wording in README for clarity readthedocs/preview #551: Pull request #5323 opened by PulindGadhia
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Add ASV benchmark for guess_bonds readthedocs/preview #550: Pull request #5321 opened by Ananya-vit
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Docs: document 'all' selection keyword readthedocs/preview #549: Pull request #5319 opened by vrundaa17
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Add ASV benchmark for trajectory iteration performance readthedocs/preview #548: Pull request #5314 opened by Anirudhpatil367
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Clarify principal_axes() documentation regarding axis orientation readthedocs/preview #547: Pull request #5311 opened by AkshitBoora
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Fix PDF documentation build configuration readthedocs/preview #546: Pull request #5310 opened by sonu-saini19
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BEN: Add HydrogenBondAnalysis benchmark for performance tracking readthedocs/preview #545: Pull request #5309 opened by Dreamstick9
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Fix documentation for geometric selections with PBC (#2166) readthedocs/preview #542: Pull request #5305 opened by AkshitBoora
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