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FIX: Handle a non-linear FrameIterator in HydrogenBondAnalysis readthedocs/preview #491: Pull request #5202 opened by BradyAJohnston
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nojump.py raises a valueerror when applied not at first frame readthedocs/preview #490: Pull request #5201 opened by spyke7
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Remove defunct macos-13 from CI readthedocs/preview #489: Pull request #5198 opened by IAlibay
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Add LLM/AI code disclosure section to PR template readthedocs/preview #488: Pull request #5196 opened by IAlibay
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Fix hbond autocorrel readthedocs/preview #487: Pull request #5195 opened by Dreamstick9
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Add cylindrical selection test using PeriodicKDTree readthedocs/preview #486: Pull request #5194 opened by rishinamdev17
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Implement scipy.spatial.cKDTree for orthorhombic and no PBC readthedocs/preview #485: Pull request #5193 opened by Aryaman-Chaudhri
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Fix failing doctest in rms.py readthedocs/preview #484: Pull request #5192 opened by mohammadghazaal
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Add IMDv3 protocol citation placeholder and instructions readthedocs/preview #483: Pull request #5190 opened by Lavu1807
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Relaxed DSSP hydrogen-guessing test to allow small boundary shifts readthedocs/preview #482: Pull request #5189 opened by sushk2904
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WIP: Test mypy full-deps install issue readthedocs/preview #481: Pull request #5188 opened by PardhavMaradani
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feat: Add support for reading unit cell dimensions from MOL2 CRYSIN records readthedocs/preview #480: Pull request #5187 opened by Dreamstick9
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Fix mypy linter check readthedocs/preview #479: Pull request #5185 opened by PardhavMaradani
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Add a current frame iterator for streamed trajectories readthedocs/preview #478: Pull request #5184 opened by PardhavMaradani
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ENH: Change get_hbond_map to use KDTree for distance search readthedocs/preview #477: Pull request #5182 opened by BradyAJohnston
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Maint: Disable build isolation in pip cron tests readthedocs/preview #476: Pull request #5181 opened by Dreamstick9
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Add test to cover unit conversion path in DMSReader readthedocs/preview #475: Pull request #5180 opened by tanii1125
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Add Type Hints to MDAnalysis.analysis.rms readthedocs/preview #474: Pull request #5179 opened by Agarwalchetan
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tests: modernize deprecated numpy assertions in test_gnm.py (ref #3743) readthedocs/preview #473: Pull request #5178 opened by shubhammittal2241
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Add RMSFResidue analysis class for per-residue RMSF computation readthedocs/preview #472: Pull request #5176 opened by Nitin-Prata
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tests: modernize deprecated numpy assertions in test_gnm.py (ref #3743) readthedocs/preview #471: Pull request #5175 opened by shubhammittal2241
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tests: modernize deprecated numpy assertions in test_gnm.py (ref #3743) readthedocs/preview #470: Pull request #5174 opened by shubhammittal2241
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Fixes #5170: Improve msd_type parsing readthedocs/preview #469: Pull request #5173 opened by tanii1125
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Fixes #3743: Modernize test assertions in test_msd.py readthedocs/preview #468: Pull request #5171 opened by tanii1125
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Fixes #3743: Modernize test assertions in test_msd.py readthedocs/preview #467: Pull request #5169 opened by tanii1125
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