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v1.0.0-rc.176 (#86)
* jfjoch_broker: Optional live Rugnux analysis of DECTRIS rotation collections inside the broker, with merged data, maps and the placed model written beside the master file, the rotation lattice in the scan result, and a "Rugnux live" tab and dashboard row in the web frontend.
* Rugnux: Faster processing, with molecular replacement and model validation spread over several GPUs and run on the Apple GPU on macOS.
* Rugnux: The polarization stated in miniCBF and d*TREK headers is used, twinned crystals' space groups are decided more reliably, and a run that finds no lattice still reports every image.

Reviewed-on: #86
Co-authored-by: Filip Leonarski <filip.leonarski@psi.ch>
2026-10-19 07:03:28 +02:00

254 lines
11 KiB
C++

// SPDX-FileCopyrightText: 2024 Filip Leonarski, Paul Scherrer Institute <filip.leonarski@psi.ch>
// SPDX-License-Identifier: GPL-3.0-only
#include "JFJochReceiver.h"
#include "../common/CUDAWrapper.h"
#include "../common/time_utc.h"
#include "JFJochCompressor.h"
JFJochReceiver::JFJochReceiver(const DiffractionExperiment &in_experiment,
ImageBuffer &in_image_buffer,
ImagePusher &in_image_pusher,
JFJochReceiverCurrentStatus &in_current_status,
JFJochReceiverPlots &in_plots,
const SpotFindingSettings &spot_finding_settings,
Logger &logger,
const PixelMask &in_pixel_mask,
ZMQPreviewSocket *in_zmq_preview_socket,
ZMQMetadataSocket *in_zmq_metadata_socket,
IndexerThreadPool *indexing_thread_pool)
: logger(logger),
experiment(in_experiment),
spot_finding_settings(spot_finding_settings),
image_buffer(in_image_buffer),
image_pusher(in_image_pusher),
zmq_preview_socket(in_zmq_preview_socket),
zmq_metadata_socket(in_zmq_metadata_socket),
current_status(in_current_status),
plots(in_plots),
scan_result(in_experiment),
serialmx_filter(in_experiment),
pixel_mask(in_pixel_mask),
// retain_outcomes=false for now: online scaling/merge at the end is not enabled yet, so the
// whole-run integration_outcome is unused here. Flip back to true when online scaling lands.
indexer(experiment, indexing_thread_pool, false, /*real_time=*/true) {
logger.Info("Initializing receiver");
// Ensure there is nothing running for now
if (!image_buffer.Finalize(std::chrono::seconds(1)))
throw JFJochException(JFJochExceptionCategory::WrongDAQState,
"There are unfinished preview/sending jobs in the buffer");
logger.Info("Image buffer from previous run finalized");
current_status.SetProgress(0);
current_status.SetEfficiency({});
current_status.SetStatus(JFJochReceiverStatus{}); // GetStatus() is virtual function and cannot be called yet!
auto start_time_point = std::chrono::steady_clock::now();
az_int_mapping = std::make_unique<AzimuthalIntegrationMapping>(experiment, pixel_mask);
auto end_time_point = std::chrono::steady_clock::now();
auto duration = std::chrono::duration<float>(end_time_point - start_time_point);
logger.Info("Azimuthal integration mapping done in {:.5f} s with {} threads", duration.count(), az_int_mapping->GetNThreads());
plots.Setup(experiment, *az_int_mapping);
push_images_to_writer = (experiment.GetImageNum() > 0) && (!experiment.GetFilePrefix().empty());
}
JFJochReceiver::~JFJochReceiver() = default;
SpotFindingSettings JFJochReceiver::GetSpotFindingSettings() {
std::unique_lock ul(spot_finding_settings_mutex);
return spot_finding_settings;
}
void JFJochReceiver::UpdateMaxImageSent(int64_t image_number) {
std::unique_lock ul(max_image_number_sent_mutex);
if (image_number + 1 > max_image_number_sent)
max_image_number_sent = image_number + 1;
}
void JFJochReceiver::UpdateMaxImageReceived(int64_t image_number) {
std::unique_lock ul(max_image_number_received_mutex);
if (image_number + 1 > max_image_number_received)
max_image_number_received = image_number + 1;
}
void JFJochReceiver::UpdateMaxDelay(uint64_t delay) {
std::unique_lock ul(max_delay_mutex);
if (!max_delay || (delay > max_delay))
max_delay = delay;
}
JFJochReceiverStatus JFJochReceiver::GetStatus() const {
JFJochReceiverStatus ret;
ret.indexing_rate = plots.GetIndexingRate();
ret.bkg_estimate = plots.GetBkgEstimate();
if ((experiment.GetImageNum() > 0) && (compressed_size > 0)) {
ret.compressed_ratio = static_cast<double>(uncompressed_size) / static_cast<double>(compressed_size);
}
ret.saturated_pixels = saturated_pixels.Read();
ret.error_pixels = error_pixels.Read();
ret.roi_beam_npixel = roi_beam_npixel.Read();
ret.roi_beam_sum = roi_beam_sum.Read();
ret.compressed_size = compressed_size;
ret.max_receive_delay = max_delay;
ret.max_image_number_sent = max_image_number_sent;
ret.images_collected = images_collected;
ret.images_sent = images_sent;
ret.images_skipped = images_skipped;
ret.images_written = image_pusher.GetImagesWritten();
ret.cancelled = cancelled;
ret.efficiency = GetEfficiency();
return ret;
}
void JFJochReceiver::SendStartMessage() {
StartMessage message{};
experiment.FillMessage(message);
message.arm_date = time_UTC(std::chrono::system_clock::now());
message.az_int_q_bin_count = az_int_mapping->GetQBinCount();
message.az_int_bin_to_q = az_int_mapping->GetBinToQ();
message.az_int_bin_to_two_theta = az_int_mapping->GetBinToTwoTheta();
message.az_int_phi_bin_count = az_int_mapping->GetAzimuthalBinCount();
if (az_int_mapping->GetAzimuthalBinCount() > 1) {
message.az_int_bin_to_phi = az_int_mapping->GetBinToPhi();
message.az_int_map = az_int_mapping->GetPixelToBin();
}
message.writer_notification_zmq_addr = image_pusher.GetWriterNotificationSocketAddress();
message.rois = experiment.ROI().ExportMetadata();
if (!experiment.ROI().empty())
message.roi_map = experiment.ExportROIMap();
message.max_spot_count = experiment.GetMaxSpotCount();
std::vector<uint32_t> nexus_mask;
message.pixel_mask["default"] = pixel_mask.GetMask(experiment);
SaveStartMessageToImageBuffer(message);
if (push_images_to_writer)
image_pusher.StartDataCollection(message);
if (zmq_preview_socket != nullptr)
zmq_preview_socket->StartDataCollection(message);
if (zmq_metadata_socket != nullptr)
zmq_metadata_socket->StartDataCollection(message);
}
void JFJochReceiver::SaveStartMessageToImageBuffer(const StartMessage &msg) {
std::vector<uint8_t> buffer(MESSAGE_SIZE_FOR_START_END);
CBORStream2Serializer serializer(buffer.data(), buffer.size());
serializer.SerializeSequenceStart(msg);
buffer.resize(serializer.GetBufferSize());
image_buffer.SaveStartMessage(buffer);
}
void JFJochReceiver::SendEndMessage() {
EndMessage message{};
message.max_image_number = max_image_number_sent;
message.images_collected_count = images_collected;
message.images_sent_to_write_count = images_sent;
message.max_receiver_delay = max_delay;
message.efficiency = GetEfficiency();
message.end_date = time_UTC(std::chrono::system_clock::now());
message.run_number = experiment.GetRunNumber();
message.run_name = experiment.GetRunName();
message.bkg_estimate = plots.GetBkgEstimate();
message.spindle_blind_fraction = plots.GetSpindleBlindFraction();
message.ice_ring_score_mean = plots.GetIceRingScore();
message.indexing_rate = plots.GetIndexingRate();
message.az_int_result["dataset"] = plots.GetAzIntProfile();
const auto rotation_indexer_ret = indexer.FinalizeRotationIndexing();
if (rotation_indexer_ret.has_value()) {
message.rotation_lattice = rotation_indexer_ret->lattice;
message.rotation_lattice_type = LatticeMessage{
.centering = rotation_indexer_ret->search_result.centering,
.niggli_class = rotation_indexer_ret->search_result.niggli_class,
.crystal_system = rotation_indexer_ret->search_result.system
};
message.rotation_extra_lattices = rotation_indexer_ret->extra_lattices;
rotation_indexing_lattice = rotation_indexer_ret->lattice;
rotation_indexing_lattice_type = message.rotation_lattice_type;
}
message.unit_cell = indexer.GetConsensusUnitCell();
// The collection does not stop for an indexer that failed - the images are written regardless - but
// its indexing rate is then not a statement about the crystal, and the log has to say so.
if (const int64_t n = indexer.GetIndexerErrorCount(); n > 0) {
try {
indexer.RethrowIndexerError();
} catch (const std::exception &e) {
logger.Error("Indexing failed {} times in this collection, first with: {}. Those attempts are "
"left out of the indexing rate, and a rotation lattice may be missing for the same "
"reason", n, e.what());
}
}
for (int i = 0; i < adu_histogram_module.size(); i++)
message.adu_histogram["module" + std::to_string(i)] = adu_histogram_module[i]->GetHistogram();
scan_result.FillEndMessage(message);
AddToEndMessage(message);
if (push_images_to_writer) {
if (!image_pusher.EndDataCollection(message))
logger.Error("End message not sent via ZeroMQ (time-out)");
logger.Info("Disconnected from writers");
}
// The result blocks (AddToEndMessage) are megabytes only the writer needs.
message.merged.reset();
message.map_coefficients.reset();
message.placed_model.reset();
if (zmq_metadata_socket != nullptr)
zmq_metadata_socket->EndDataCollection(message);
if (zmq_preview_socket != nullptr)
zmq_preview_socket->EndDataCollection(message);
}
JFJochReceiverOutput JFJochReceiver::GetFinalStatistics() const {
JFJochReceiverOutput ret;
ret.efficiency = GetEfficiency();
ret.start_time_ms = std::chrono::duration_cast<std::chrono::milliseconds>(start_time.time_since_epoch()).count();
ret.end_time_ms = std::chrono::duration_cast<std::chrono::milliseconds>(end_time.time_since_epoch()).count();
ret.writer_queue_full_warning = writer_queue_full;
ret.status = GetStatus();
ret.writer_err = writer_error;
ret.scan_result = scan_result.GetResult();
ret.scan_result.rotation_lattice = rotation_indexing_lattice;
if (rotation_indexing_lattice_type) {
ret.scan_result.rotation_crystal_system = rotation_indexing_lattice_type->crystal_system;
ret.scan_result.rotation_centering = rotation_indexing_lattice_type->centering;
}
ret.images_written = images_written;
ret.processing_time = plots.GetMeanProcessingTime();
return ret;
}
void JFJochReceiver::Cancel(bool silent) {
if (!silent) {
// Remote abort: This tells FPGAs to stop but doesn't do anything to CPU code
logger.Warning("Cancelling on request");
cancelled = true;
}
}
void JFJochReceiver::Cancel(const JFJochException &e) {
logger.Error("Cancelling data collection due to exception");
logger.ErrorException(e);
// Error abort: This tells FPGAs to stop and also prevents deadlock in CPU code by setting abort to 1
cancelled = true;
}