leonarski_f leonarski_f
  • Joined on 2025-02-24
leonarski_f pushed to 2602-scaling-d-limit at mx/Jungfraujoch 2026-02-23 15:22:43 +01:00
64390c71d1 ScaleAndMerge: Don't allow zero in still mode (need to figure out proper bounds...)
94aea965eb jfjoch_process: Add still partiality model (though why it fails)?
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leonarski_f pushed to 2602-scaling-d-limit at mx/Jungfraujoch 2026-02-23 14:43:19 +01:00
f8c326191f ScaleAndMerge: Refine partiality model options
leonarski_f pushed to 2602-scaling-d-limit at mx/Jungfraujoch 2026-02-22 12:55:04 +01:00
3a33944dc4 ScaleAndMerge: Set iteration limit to 10
7535ba56e3 ScaleAndMerge: Add more partiality models
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leonarski_f pushed to 2602-scaling-d-limit at mx/Jungfraujoch 2026-02-20 18:16:42 +01:00
5527fd0aa2 IndexAndRefine: For the moment - symmetry is enforced only if space group and unit cell are both provided
leonarski_f pushed to 2602-scaling-d-limit at mx/Jungfraujoch 2026-02-20 15:28:19 +01:00
745755184a ScaleAndMerge: Split code into functions
6eeb9c0449 jfjoch_viewer: Read image scale factor
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leonarski_f pushed to 2602-scaling-d-limit at mx/Jungfraujoch 2026-02-20 14:12:29 +01:00
b5a7ae14ff jfjoch_tests: Fix ordering of unit cell of lysozyme
leonarski_f pushed to 2602-scaling-d-limit at mx/Jungfraujoch 2026-02-20 13:41:11 +01:00
ff6e02046a ScaleAndMerge: Fix still case (though it doesn't really work at the moment)
c33366f3d6 IndexAndRefine: Use mosaicity from indexing for scaling
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leonarski_f created branch 2602-scaling-d-limit in mx/Jungfraujoch 2026-02-20 11:48:44 +01:00
leonarski_f pushed to 2602-scaling-d-limit at mx/Jungfraujoch 2026-02-20 11:48:44 +01:00
203eefca66 jfjoch_process: Save scale factors
3819fe5a86 ScaleAndMerge: add option to cluster images for refinement (faster convergence, but pays price in quality)
e6e0f5b2f0 ScaleAndMerge: clean-up (no log residual, no fixed mosaicity, return per-image values)
43c3402198 ScaleMerge: Simplify by removing log residual
eefea7f36b XtalOptimizer: Don't regularize lattices at input, as this can give problems to downstream procedures. We assume that SearchLattice gave reasonable response. Need to better handle this in the future.
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leonarski_f released Release 1.0.0-rc.126 at mx/Jungfraujoch 2026-02-19 07:29:20 +01:00
leonarski_f pushed tag 1.0.0-rc.126 to mx/Jungfraujoch 2026-02-19 07:29:20 +01:00
leonarski_f pushed to main at mx/Jungfraujoch 2026-02-19 07:01:39 +01:00
32b681e591 v1.0.0-rc.126 (#33)
leonarski_f merged pull request mx/Jungfraujoch#33 2026-02-19 07:01:38 +01:00
v1.0.0-rc.126
leonarski_f pushed to 2602-residual at mx/Jungfraujoch 2026-02-18 22:35:36 +01:00
b78ee35569 XtalOptimizer: Have one function to rebuild lattice from three arrays
leonarski_f created pull request mx/Jungfraujoch#33 2026-02-18 22:15:35 +01:00
v1.0.0-rc.126
leonarski_f pushed to 2602-residual at mx/Jungfraujoch 2026-02-18 22:14:48 +01:00
50ec0fa1c7 XtalOptimizerTest: Check distance refinement
298ce8fd8e CHANGELOG
b4d22f0030 VERSION: 1.0.0-rc.126
c6183f2e01 XtalOptimizer: Extend test a bit
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leonarski_f pushed to 2602-residual at mx/Jungfraujoch 2026-02-18 21:17:26 +01:00
5cfd8bcc13 XtalOptimizer: Fix error
leonarski_f pushed to 2602-residual at mx/Jungfraujoch 2026-02-18 20:45:06 +01:00
7634cd819a XtalOptimizer: Fix how monoclinic is generated
leonarski_f pushed to 2602-residual at mx/Jungfraujoch 2026-02-18 20:10:58 +01:00
f05c1977f9 jfjoch_process: output lattice vectors
leonarski_f created branch 2602-residual in mx/Jungfraujoch 2026-02-18 20:02:35 +01:00