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eval: script for classifying conformational changes (#223) Release #36: Commit fbf6d38 pushed by k-chrispens
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0.6.2 Release #35: Commit 6e7a8cf pushed by diffuse-semantic-release Bot
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fix(rf3): bind Fabric to caller-specified GPU (#222) Release #34: Commit ad70806 pushed by k-chrispens
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test(msa): add MSAManager unit tests (#178) (#220) Release #33: Commit a777440 pushed by k-chrispens
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0.6.1 Release #32: Commit fec8bc0 pushed by diffuse-semantic-release Bot
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fix: remap container paths to host paths in job_metadata.json (#218) Release #31: Commit e965808 pushed by k-chrispens
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0.6.0 Release #30: Commit f57044e pushed by diffuse-semantic-release Bot
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feat: Add unified CLI for run_guidance and fix missing args bug (#207) Release #29: Commit aa6e8a3 pushed by Abdelsalam-Abbas
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0.5.0 Release #28: Commit 441c81d pushed by diffuse-semantic-release Bot
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feat(ciffiles): store metadata about ensemble generation directly in … Release #27: Commit e66b543 pushed by k-chrispens
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Add configurable recycling steps and diffusion step count parameters … Release #26: Commit 14ba724 pushed by marcuscollins
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0.4.4 Release #25: Commit 02b774e pushed by diffuse-semantic-release Bot
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fix(docker): combine pixi installs into single RUN to prevent disk-fu… Release #24: Commit bc2cb94 pushed by marcuscollins
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Speed up Docker build: free disk space, drop broken cache (#204) Release #23: Commit 41512b1 pushed by Abdelsalam-Abbas
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0.4.3 Release #22: Commit cd0e7e6 pushed by diffuse-semantic-release Bot
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fix(ci): run semantic-release as CLI instead of Docker action (#203) Release #21: Commit 482e9bf pushed by Abdelsalam-Abbas
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fix(ci): regenerate pixi.lock during semantic-release version bumps (… Release #20: Commit 8c5455b pushed by Abdelsalam-Abbas
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0.4.2 Release #19: Commit 95e8b86 pushed by diffuse-semantic-release Bot
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chore(release): use GitHub App token instead of PAT (#200) Release #18: Commit 64afe6f pushed by k-chrispens
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fix(ci): switch gpu-tests to pull_request_target to prevent approval … Release #17: Commit cd0a519 pushed by k-chrispens
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bug:remove B-factors from input structures before stacking them in ma… Release #16: Commit 0b056d0 pushed by marcuscollins
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fix:problem with heterogeneous HETATM/ATOM in the same position in di… Release #15: Commit 15de1e9 pushed by marcuscollins
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ci: Add CI workflow for lint, typecheck, and CPU tests (#189) Release #14: Commit 025fbd8 pushed by k-chrispens
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0.4.1 Release #13: Commit bcfb45c pushed by k-chrispens
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fix(rf3): fix issues with 5I09 due to chain breaks and add associated… Release #12: Commit bc044a1 pushed by k-chrispens
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