Release 2026.2.0 - #553

Merged

lohedges merged 33 commits into

mainfrom

release_2026.2.0

Sep 15, 2026

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
lohedges
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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
lohedges
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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
lohedges
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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
lohedges
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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

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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477dba0