Filip LeonarskiandClaude Opus 5.5
4e177bdb21
The loop's corr now lives in the group CSR's order next to the references (the partials in no group after them), so the group means read both sequentially instead of gathering corr through the permutation, and the corr update walks the same arrays. FitPerFrameG's filters, which do not change over the loop, are applied once into a per-frame ScalingFit list with the reference-independent factors precomputed (FitScalingFrames). ReferenceWeight is inline, and the group means are no longer pre-filled with NaN serially. Same values, same operations in the same order: p.hkl and the merged and unmerged MTZ data are byte-identical on lysozyme, cytochrome C, myoglobin, a small-molecule set and 4nwv. On 4nwv (Apple M6, 12 threads) the partial scaling iterations take 3-4x less time, ~18 s -> ~6 s over 168 iterations. Co-Authored-By: Claude Opus 5.5 <noreply@anthropic.com>
Jungfraujoch
Application to receive and analyse data from the PSI JUNGFRAU and EIGER detectors, together with
rugnux, its program for processing stored diffraction data - rotation and serial, macromolecular
and small-molecule - from images to merged reflections.
All documentation is now placed in docs/ subdirectory and for the current version hosted on Jungfraujoch Read The Docs page.