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AgeCommit message (Collapse)Author
2021-04-08Record infinite values as 'null' in JSONThomas White
Infinity isn't allowed in JSON. 'Null' should serve equally well to indicate "the relevant feature has been switched off".
2021-04-08indexamajig: Add a missing harvest parameterThomas White
2021-04-01Local BE: Fix ownership of workdir GFileThomas White
2021-04-01GUI: Wrap filenames in job scripts in quotes, where appropriateThomas White
This makes it work when the filenames contain spaces.
2021-04-01GUI: Clean up old tasks when infobar is removedThomas White
2021-03-31indexamajig: Handle spaces in filename when retrieving ID from queueThomas White
2021-03-30GUI: Fail more gracefully if image file is not presentThomas White
With the new header cache, it's possible to operate completely from the stream.
2021-03-30Add header caching layerThomas White
This simultaneously implements --copy-header/--copy-hdf5-field and gives access to metadata (e.g. detector position or wavelength) when loading from a stream with header-specified values.
2021-03-29indexamajig: Don't write harvest file if serial start is >1Thomas White
This will avoid multiple indexamajig processes from overwriting the others' files when running a batch job.
2021-03-26partialator: Add missing comma in JSONThomas White
2021-03-26GUI: Tell indexamajig and partialator to write parameter harvest filesThomas White
2021-03-26GUI: Add missing model parameter for mergingThomas White
Whoops.
2021-03-26partialator: Add --harvest-fileThomas White
2021-03-26indexamajig: Add --harvest-fileThomas White
2021-03-26Rearrange 'struct index_args' and remove unused elementsThomas White
"cmfilter" and "integrate_saturated" were unused.
2021-03-25indexamajig: Add --camera-length-estimateThomas White
Unfortunately, PinkIndexer needs the real camera length for its centre refinement. Giving a fake value and scaling the resulting shift does not work - the indexing rate drops with even a small error. Ideally, this would work in the same way as --wavelength-estimate, by using a static value from the geometry file if it's given. However, this is rather complicated to implement because of the way all the units stuff is implemented. Therefore, this is left as an improvement for the future.
2021-03-25FussinessThomas White
The FIXMEs have both already been fixed.
2021-03-19Merge branch 'tom/fromfile'Thomas White
2021-03-19FromFile indexer: Option processingThomas White
This give FromFile its own private command-lien option processing, like the other indexers. It removes the ability to auto-generate the solution filename, but I don't think there's a way to do that without breaking abstractions.
2021-03-17CrystFELImageView: Fix zoom limitsThomas White
2021-03-17GUI: Show beam centre more clearly, and optionallyThomas White
2021-03-16CrystFELImageView: Avoid crash when scrolling after image load failureThomas White
2021-03-16get_hkl: Fix logic for loading unit cellThomas White
2021-03-16get_hkl: Add options to export to MTZ and XDSThomas White
2021-03-16Move MTZ and XDS export to libcrystfelThomas White
2021-03-15GUI: Add interface for --fix-profile-radius and --fix-divergenceThomas White
2021-03-12GUI: Add NULL filename for FromFile indexing (which isn't used here)Thomas White
2021-03-12Clean up after mergeThomas White
2021-03-12Merge branch 'pascal/electrons'Thomas White
2021-03-11indexamajig: Use static wavelength from DataTemplate as estimateThomas White
If the geometry file contains a literal wavelength, then let's use it. That's better than nagging the user for a --wavelength-estimate.
2021-03-11indexamajig: Add --max-indexer-threadsThomas White
This is a more general replacement for --pinkIndexer-thread-count.
2021-03-11indexamajig: Remove misleading messageThomas White
Spectrum file is currently not supported at all. Maybe later.
2021-03-11PinkIndexer: Remove custom indexing checksThomas White
These conflict badly with CrystFEL's own checks, creating a horrible user and developer experience. Later, if we want to handle wide bandwidth beams, we will improve the central CrystFEL checks to support it.
2021-03-11detgeom_transform_coords: Take an additional detector shiftThomas White
This allows the refined detector position to be used in a lot of places.
2021-03-11setup_indexing: Remove dtemplThomas White
There is absolutely nothing useful that an indexing algorithm can do with the opaque DataTemplate object.
2021-03-11indexamajig: Add --wavelength-estimateThomas White
This is a more sensible non-indexer-specific and non-Xray-specific replacement for --pinkIndexer-override-photon-energy
2021-03-05Mass update of copyright dates in source code commentsThomas White
2021-03-04SLURM: Better handling of job cancellation/crashingThomas White
2021-03-04SLURM: Cancel job by calling scancelThomas White
The API for cancelling a job seems to be Complicated. The source code for scancel is nearly a thousand lines long! The API also seems to have just changed. So, let's just run scancel and be done with it.
2021-03-04SLURM: Add one to serial offsetsThomas White
They should start from 1, not 0.
2021-03-04SLURM: Set serial offset for indexamajig jobsThomas White
2021-03-04GUI: When starting indexing, prefix relative filenames with ../Thomas White
2021-03-04read_number_processed: Only look at end of log fileThomas White
2021-03-04SLURM: Clean up some exit pathsThomas White
2021-03-04start_slurm_job: Save the real stderr filenameThomas White
2021-03-04SLURM: Implement indexing progress monitoring for job arraysThomas White
2021-03-03GUI: Submit indexing jobs as job arrays, not individual jobsThomas White
2021-03-03SLURM: Remove unused stuffThomas White
2021-03-03SLURM: Add access to account and feature constraintsThomas White
2021-03-03SLURM: Factorise common options even moreThomas White
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