leonarski_fandFilip Leonarski
19b135186d
* Rugnux: Processes a collection live while jfjoch_broker writes it (`rugnux <master.h5> <broker URL>`). * Rugnux: Processing starts on the first images and confirms its choices once all are in, so analysis can begin during collection. * Rugnux: Faster processing, especially on servers with several GPUs and CPU sockets and on computers without a GPU (`--no-gpu`, macOS). * Rugnux: Uses much less GPU memory, so large data sets stay on the GPU of smaller cards, and a data set too large for the card is processed on the CPU instead. * Rugnux: On macOS, Bragg integration runs on the Apple GPU. * Rugnux: Better handling of twinning and pseudo-symmetry, with the twin hypothesis written as `<prefix>_twin_<SG>.mtz`, and a wrong `--model` no longer confirms the data or decides the hand. * Rugnux: `--model` accepts predicted (AlphaFold) models and falls back to molecular replacement when the model is not placed as a rigid body (experimental `--mr` forces it), settling space group, hand and twinning and writing a different answer as `<prefix>_mr.mtz`. * Rugnux: Molecular replacement is faster and settles the space group in more cases with several copies in the asymmetric unit. * Rugnux: Deposition-ready mmCIF, a richer report, and numbered steps on the terminal with the full log in `<prefix>_log.txt`; `_P1.mtz`, `--estimate-beam-center` and `--beam-center-search` are removed. * Rugnux: The beam-stop shadow is found correctly on tilted detectors. * Rugnux: Stills files that record a stationary goniometer axis get the default stills geometry refinement. * jfjoch_viewer: "Analyze dataset" uses the same defaults as a bare `rugnux <file>`, and shows the results of processed CBF, marCCD and SMV sweeps. * jfjoch_viewer: The Files panel refreshes on F5 and every few seconds, and the plot type and other selections stay put during live collection. * jfjoch_writer: Memory stays bounded and old data files are closed efficiently on long runs, any failure ends the run in an error state the broker is told about, and the master file appears only after its data files; the ZeroMQ pusher logs when a stalled writer makes it drop images. * Fixes: The TCP image pusher no longer blocks the broker's receiver, GPU out-of-memory failures stop with a clear message, and the XDS plugin masks module and chip edges. --------- Co-authored-by: Filip Leonarski <jungfrau@filips-mac-mini.home> Reviewed-on: #85 Co-authored-by: Filip Leonarski <filip.leonarski@psi.ch>
1.7 KiB
PSI Jungfraujoch
Jungfraujoch is data acquisition and on-the-fly analysis system developed by the Paul Scherrer Institut.
It can be currently used with PSI and DECTRIS detectors.
Its data-processing half is rugnux — start at rugnux <RUGNUX> to
process a stored dataset, and at the broker <JFJOCH_BROKER> to acquire one.
Jungfraujoch is distributed under the GPLv3 license.
RUGNUX RUGNUX_OVERVIEW RUGNUX_INSTALL RUGNUX_FORMATS RUGNUX_TUTORIAL RUGNUX_INTEGRATION RUGNUX_REPORT RUGNUX_ADVANCED RUGNUX_MODEL_AND_REFERENCE RUGNUX_CALIBRATION RUGNUX_BENCHMARKING CPU_DATA_ANALYSIS CPU_DATA_ANALYSIS_IMAGE CPU_DATA_ANALYSIS_INDEXING CPU_DATA_ANALYSIS_INTEGRATION CPU_DATA_ANALYSIS_DECISIONS GPU_DATA_ANALYSIS
JFJOCH_BROKER JFJOCH_WRITER JFJOCH_VIEWER SOFTWARE_INTEGRATION TOOLS DEPLOYMENT DETECTORS HARDWARE SOFTWARE
FPGA FPGA_LICENSE FPGA_DESIGN FPGA_NETWORK FPGA_PCIE_DRIVER FPGA_SETTINGS FPGA_DATA_ANALYSIS
DETECTOR_GEOMETRY OPENAPI OPENAPI_SPECS PYTHON_CLIENT CBOR HDF5 IMAGE_STREAM PIXEL_MASK WEB_FRONTEND TESTS
ACKNOWLEDGEMENT EXTERNAL_TEST_DATA LICENSE THIRD_PARTY_NOTICES VERSIONING SECURITY RELEASE_CONTENTS REPOSITORIES NAMING CHANGELOG