leonarski_fandClaude Opus 5.5
7c49fefb54
The cell e.s.d.s and the unmerged MTZ read only the integrated observations and the group, both final once the model has been read, and the refinement reads neither: both now start before the refinement instead of after it. In MakeMaps the difference map is made on its own thread while the anomalous map is made. Outputs identical (MTZ data, CIF/HKL/INS, refined model, maps, blobs, report minus provenance) on the thaumatin and cytochrome C live runs. Live path without the unmerged MTZ (as the broker runs it), step Refinement: thaumatin 2.76 -> 2.40 s, cytochrome C 1.99 -> 1.93 s. With the unmerged MTZ (CLI), Refinement + Writing files: 3.21 -> 2.67 s and 3.33 -> 2.80 s. Co-Authored-By: Claude Opus 5.5 <noreply@anthropic.com> Claude-Session: https://claude.ai/code/session_015CeEGgpKdfkCTJb3YNMJcu
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.