v0.6.2

v0.6.2 (2026-04-16)

Bug Fixes

• rf3: Bind Fabric to caller-specified GPU (#222, ad70806)

Testing

• msa: Add MSAManager unit tests (#178) (#220, a777440)

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Detailed Changes: v0.6.1...v0.6.2

v0.6.1

v0.6.1 (2026-04-14)

Bug Fixes

• Remap container paths to host paths in job_metadata.json (#218, e965808)

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Detailed Changes: v0.6.0...v0.6.1

v0.6.0

v0.6.0 (2026-04-11)

Features

• Add unified CLI for run_guidance and fix missing args bug (#207, aa6e8a3)

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Detailed Changes: v0.5.0...v0.6.0

v0.5.0

v0.5.0 (2026-04-10)

Features

• ciffiles: Store metadata about ensemble generation directly in output CIF files. (#209, e66b543)

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Detailed Changes: v0.4.4...v0.5.0

v0.4.4

v0.4.4 (2026-04-09)

Bug Fixes

• docker: Combine pixi installs into single RUN to prevent disk-full (#206, bc2cb94)

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Detailed Changes: v0.4.3...v0.4.4

v0.4.3

v0.4.3 (2026-04-08)

Bug Fixes

• ci: Regenerate pixi.lock during semantic-release version bumps (#202, 8c5455b)

• ci: Run semantic-release as CLI instead of Docker action (#203, 482e9bf)

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Detailed Changes: v0.4.2...v0.4.3

v0.4.2

v0.4.2 (2026-04-03)

Bug Fixes

• ci: Switch gpu-tests to pull_request_target to prevent approval bypass (#199, cd0a519)

Chores

• release: Use GitHub App token instead of PAT (#200, 64afe6f)

Continuous Integration

• Add CI workflow for lint, typecheck, and CPU tests (#189, 025fbd8)

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Detailed Changes: v0.4.1...v0.4.2

v0.4.1

v0.4.1 (2026-03-27)

Bug Fixes

• rf3: Fix issues with 5I09 due to chain breaks and add associated tests (#190, bc044a1)

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Detailed Changes: v0.4.0...v0.4.1

v0.4.0

v0.4.0 (2026-03-25)

Features

• Completing evaluation suite for v0 and documenting how to run evaluations (#186, 9c1d738)

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Detailed Changes: v0.3.2...v0.4.0

v0.3.2

v0.3.2 (2026-03-25)

Bug Fixes

• Docker workflow fix and small doc change for RF3 chiral gradient disabling (#187, 887b40d)

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Detailed Changes: v0.3.1...v0.3.2