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Release 2026.2.0 - #553

Merged

lohedges merged 33 commits into

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release_2026.2.0

Sep 15, 2026

Merged

Release 2026.2.0#553
lohedges merged 33 commits into
mainfrom
release_2026.2.0

Commits on Jun 29, 2026
- Update Sire development pin.
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  7d02f70
- Add note regarding PyMBAR JAX issues.
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  c7b1d50
Commits on Jul 17, 2026
- Add script to autogenerate roadmap page for website. [ci skip]
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  8b86bac
- Merge pull request #532 from OpenBioSim/feature_roadmap
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  authored
  64f6200
Commits on Jul 28, 2026
- Use pip_check: false to avoid NumPy pin errors with AmberTools.
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  abbfb7b
- Merge pull request #537 from OpenBioSim/fix_536 [ci skip]
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  cd6b45f
Commits on Jul 29, 2026
Commits on Jul 30, 2026
- Warn when a mapping stops short at a pairable attachment point.
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  b049629
Commits on Jul 31, 2026
Commits on Aug 1, 2026
- Merge pull request #544 from OpenBioSim/feature_mapping_diagnostic
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  dcff2b0
Commits on Aug 4, 2026
- Use native lazy import implementation.
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  4aaeefc
Commits on Aug 5, 2026
- Merge pull request #546 from OpenBioSim/fix_545
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  9f13077
Commits on Aug 24, 2026
- Match tar files by extension. [closes #547]
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  6b494d3
- Merge pull request #548 from OpenBioSim/fix_547
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  5bbdacd
Commits on Aug 26, 2026
- Add determine_bond_orders kwarg to RDKit conversion function.
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  01ef812
Commits on Aug 27, 2026
- Merge pull request #550 from OpenBioSim/fix_sire_464
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  f800072
Commits on Sep 1, 2026
- Fix typos and inconsistencies. [ci skip]
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  6c8d5ff
Commits on Sep 7, 2026
- Add functionality for parsing CMAP energy records.
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  6d008b1
- Merge pull request #552 from OpenBioSim/feature_cmap_energy_parsing
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  authored
  7c5d81f
Commits on Sep 14, 2026
- Merge branch 'main' into release_2026.2.0
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  1a832a0
- Update Sire version.
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  4defa62
- Update CHANGELOG.
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  committed
  477dba0

Commits

Commits on Jun 29, 2026

Commits on Jul 17, 2026

Commits on Jul 28, 2026

Commits on Jul 29, 2026

Commits on Jul 30, 2026

Commits on Jul 31, 2026

Commits on Aug 1, 2026

Commits on Aug 4, 2026

Commits on Aug 5, 2026

Commits on Aug 24, 2026

Commits on Aug 26, 2026

Commits on Aug 27, 2026

Commits on Sep 1, 2026

Commits on Sep 7, 2026

Commits on Sep 14, 2026