1.0.0-rc.174 (#84)
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* Rugnux: Performance improvements on GPU and CPU (more of the pre-scan and of scaling on the GPU, faster CPU spot finding and crystal refinement), with unchanged results.
* Rugnux: More robust processing - patches of persistently hot pixels are masked, an inconsistent merge triggers a retry at the measured beam centre, and builds targeting different CPU levels give the same results.
* Rugnux: Improved scaling and merging - reflections with an overloaded pixel are dropped, as in XDS, sparse rotation sweeps are scaled more reliably, and French-Wilson amplitudes use an anisotropic Wilson prior.
* Rugnux: Improved space-group determination - glide planes in groups without a centre of symmetry, screw axes from short or weak axial rows kept when a higher group is adopted, and more reliable decisions on twinned and pseudo-symmetric crystals.
* Rugnux: Improved small-molecule processing - spots that grow wider than the integration disk and split spots are integrated over their measured footprint, sparse lattices are integrated on every frame, and the `.hkl` file holds unmerged scaled reflections (SHELX HKLF 4).
* Rugnux: Reads Rigaku d*TREK SMV images (Saturn CCD), including detector 2theta and encoded pixel overflows; home-source (rotating-anode) datasets were added to the validation battery.
* jfjoch_viewer: Fixed processing failing at the end with "Wrong JPEG library version" on Linux; the merge window shows the space group with proper subscripts and a checklist of crystal pathologies.

Reviewed-on: #84
Co-authored-by: Filip Leonarski <filip.leonarski@psi.ch>
This commit was merged in pull request #84.
This commit is contained in:
2026-10-06 14:03:18 +02:00
committed by leonarski_f
parent 84228bf8be
commit a395f358ef
292 changed files with 11586 additions and 2438 deletions
@@ -45,6 +45,7 @@ Name | Type | Description | Notes
**max_spot_count** | **int** | Maximum number of spots that are saved/used for indexing; spots with highest intensity are selected | [optional] [default to 250]
**detect_ice_rings** | **bool** | Flag spots as ice rings and reduce their effect on indexing | [optional]
**async_start** | **bool** | When set to true, &#x60;/start&#x60; will not wait for detector and Jungfraujoch to be ready for the measurement. | [optional] [default to False]
**tokens** | **List[str]** | Bearer tokens that protect this dataset: any number, all equivalent (e.g. a beamline secret and a dataset-specific user secret). While set, the endpoints marked with the &#x60;bearerAuth&#x60; security scheme require &#x60;Authorization: Bearer &lt;token&gt;&#x60; and answer 401 otherwise. Every accepted &#x60;/start&#x60; replaces the previous dataset&#39;s tokens; omitted or empty means no protection. Never returned by any endpoint. | [optional]
**xray_fluorescence_spectrum** | [**DatasetSettingsXrayFluorescenceSpectrum**](DatasetSettingsXrayFluorescenceSpectrum.md) | | [optional]
## Example