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// ************************************************************************************************
//
// BornAgain: simulate and fit reflection and scattering
//
//! @file GUI/Model/Job/JobItem.cpp
//! @brief Implements class JobItem.
//!
//! @homepage http://www.bornagainproject.org
//! @license GNU General Public License v3 or higher (see COPYING)
//! @copyright Forschungszentrum Jülich GmbH 2018
//! @authors Scientific Computing Group at MLZ (see CITATION, AUTHORS)
//
// ************************************************************************************************
#include "GUI/Model/Job/JobItem.h"
#include "Base/Axis/Frame.h"
#include "Base/Axis/Scale.h"
#include "Device/Data/Datafield.h"
#include "Device/Detector/IDetector.h"
#include "GUI/Model/Axis/AmplitudeAxisItem.h"
#include "GUI/Model/Axis/PointwiseAxisItem.h"
#include "GUI/Model/Beam/SourceItems.h"
#include "GUI/Model/Data/Data1DItem.h"
#include "GUI/Model/Data/Data2DItem.h"
#include "GUI/Model/Detector/DetectorItem.h"
#include "GUI/Model/File/DatafileItem.h"
#include "GUI/Model/Job/BatchInfo.h"
#include "GUI/Model/Job/JobStatus.h"
#include "GUI/Model/Job/JobWorker.h"
#include "GUI/Model/Job/ParameterTreeBuilder.h"
#include "GUI/Model/Mask/MaskUtil.h"
#include "GUI/Model/Mask/MasksSet.h"
#include "GUI/Model/Par/ParameterTreeItems.h"
#include "GUI/Model/Sample/SampleItem.h"
#include "GUI/Model/Sim/SimulationOptionsItem.h"
#include "GUI/Model/ToCore/SimulationToCore.h"
#include "GUI/Model/Tune/FitSuiteItem.h"
#include "GUI/Model/Util/Backup.h"
#include "GUI/Model/Util/Path.h"
#include "GUI/Model/Util/UtilXML.h"
#include "Sim/Simulation/ISimulation.h"
namespace {
namespace Tag {
const QString Activity("Activity");
const QString BatchInfo("BatchInfo");
const QString DatafileItem("DatafileItem");
const QString FitSuite("FitSuite");
const QString Instrument("Instrument");
const QString ParameterContainer("ParameterContainer");
const QString Sample("Sample");
const QString SimulatedData("SimulatedData");
const QString SimulationOptions("SimulationOptions");
} // namespace Tag
DataItem* newDataItem(size_t rank)
{
if (rank == 1)
return new Data1DItem;
if (rank == 2)
return new Data2DItem;
ASSERT_NEVER;
}
} // namespace
JobItem::JobItem()
: m_simulation_options_item(std::make_unique<SimulationOptionsItem>())
, m_parameter_container(std::make_unique<ParameterContainerItem>())
, m_sample_item(std::make_unique<SampleItem>())
, m_batch_info(std::make_unique<BatchInfo>())
, m_fit_suite_item(std::make_unique<FitSuiteItem>())
{
}
JobItem::JobItem(const SampleItem* sampleItem, const InstrumentItem* instrumentItem,
const DatafileItem* dfile_item, const SimulationOptionsItem* optionItem)
: m_simulation_options_item(std::make_unique<SimulationOptionsItem>(*optionItem))
, m_parameter_container(std::make_unique<ParameterContainerItem>())
, m_sample_item(sampleItem->clone())
, m_batch_info(std::make_unique<BatchInfo>())
, m_fit_suite_item(std::make_unique<FitSuiteItem>())
{
ASSERT(sampleItem);
ASSERT(instrumentItem);
m_instrument.setCertainItem(instrumentItem->clone());
createParameterTree();
parameterContainerItem()->addBackupValues("Initial state");
createSimulatedDataItem();
if (dfile_item) {
copyDatafileItemIntoJob(dfile_item);
adjustRealDataToJobInstrument();
createDiffDataItem();
}
}
JobItem::~JobItem() = default;
void JobItem::setFailed()
{
if (DataItem* di = simulatedDataItem()) {
if (Datafield* df = di->p_field())
df->setAllTo(0.0);
emit di->datafieldChanged();
}
batchInfo()->setStatus(JobStatus::Failed);
}
size_t JobItem::rank() const
{
return instrumentItem()->detectorRank();
}
void JobItem::createParameterTree()
{
ParameterTreeBuilder(this).build();
}
void JobItem::createSimulatedDataItem()
{
ASSERT(!simulatedDataItem());
m_simulated_data_item.reset(::newDataItem(rank()));
}
Data1DItem* JobItem::data1DItem()
{
return dynamic_cast<Data1DItem*>(m_simulated_data_item.get());
}
Data2DItem* JobItem::data2DItem()
{
return dynamic_cast<Data2DItem*>(m_simulated_data_item.get());
}
DataItem* JobItem::createDiffDataItem()
{
ASSERT(!diffDataItem());
m_diff_data_item.reset(::newDataItem(rank()));
ASSERT(m_dfile_item);
// use the same axes as simulated item (same as external data item if loading pre-22.0 project)
const DataItem* source = m_simulated_data_item ? simulatedDataItem() : m_dfile_item->dataItem();
GUI::Util::copyContents(source->axItemX(), m_diff_data_item->axItemX());
if (rank() == 2)
GUI::Util::copyContents(source->axItemY(), m_diff_data_item->axItemY());
if (auto* spec_diff = dynamic_cast<Data1DItem*>(diffDataItem()))
spec_diff->setDiffPlotStyle();
else {
auto* intensity_diff = dynamic_cast<Data2DItem*>(diffDataItem());
ASSERT(intensity_diff);
intensity_diff->setInterpolated(m_dfile_item->data2DItem()->isInterpolated());
}
return m_diff_data_item.get();
}
void JobItem::copyDatafileItemIntoJob(const DatafileItem* source)
{
ASSERT(!dfileItem());
ASSERT(source->rank() == rank());
m_dfile_item.reset(source->clone());
if (rank() == 1)
m_dfile_item->data1DItem()->setRealPlotStyle();
else {
ASSERT(data2DItem());
data2DItem()->setInterpolated(m_dfile_item->data2DItem()->isInterpolated());
}
}
void JobItem::importMasksFromRealData()
{
auto* iiI = dynamic_cast<Scatter2DInstrumentItem*>(instrumentItem());
if (!iiI)
return;
// copy all masks from datafile to detector
iiI->detectorItem()->setMasks(dfileItem()->data2DItem()->masks());
// convert the copied masks to the coordinate system of the detector
const Frame& orig_frame = dfileItem()->data2DItem()->c_field()->frame();
const Frame det_frame = iiI->detectorItem()->createFrame();
MaskUtil::convertMasks(iiI->detectorItem()->masks(), orig_frame, det_frame);
}
void JobItem::adjustRealDataToJobInstrument()
{
if (const auto* spec_instr = dynamic_cast<const SpecularInstrumentItem*>(instrumentItem())) {
const Datafield* old = m_dfile_item->data1DItem()->c_field();
std::vector<double> flatVector = old->flatVector();
std::vector<double> errorSigmas = old->errorSigmas();
std::unique_ptr<const Frame> frame = spec_instr->createFrame();
// if needed, reverse values vector to match "reversed" frame argument axis
const BasicAxisItem* axis_item = spec_instr->scanItem()->currentAxisItem();
if (auto pointwise_axis = dynamic_cast<const PointwiseAxisItem*>(axis_item)) {
const std::string unit_1 = pointwise_axis->scale()->unit();
const std::string unit_2 = frame->axis(0).unit();
if ((unit_1 == "1/nm" && unit_2 == "nm") || (unit_1 == "nm" && unit_2 == "1/nm")) {
std::reverse(flatVector.begin(), flatVector.end());
std::reverse(errorSigmas.begin(), errorSigmas.end());
}
}
m_dfile_item->data1DItem()->setDatafield({*frame, flatVector, errorSigmas});
} else if (instrumentItem()->is<Scatter2DInstrumentItem>()) {
importMasksFromRealData();
applyMasksToRealDatafield(); // also crop Datafield to the region of interest
}
}
void JobItem::applyMasksToRealDatafield()
{
auto* iiI = dynamic_cast<Scatter2DInstrumentItem*>(instrumentItem());
ASSERT(iiI);
Data2DItem* data_item = dfileItem()->data2DItem();
std::unique_ptr<Datafield> orig_field(data_item->c_field()->clone());
std::unique_ptr<const IDetector> det = iiI->detectorItem()->createDetector();
// (re)create zero-valued Datafield with the size of region of interest.
data_item->setDatafield(det->clippedFrame());
ASSERT(det->frame().rank() == 2);
std::vector<size_t> ai = det->activeIndices();
for (unsigned long i : ai)
(*data_item->p_field())[i] = (*orig_field)[det->roiToFullIndex(i)];
data_item->updateDataRange();
}
void JobItem::writeTo(QXmlStreamWriter* w) const
{
XML::writeTaggedElement(w, Tag::SimulationOptions, *m_simulation_options_item);
XML::writeTaggedElement(w, Tag::Instrument, m_instrument);
XML::writeTaggedElement(w, Tag::Sample, *m_sample_item);
XML::writeTaggedElement(w, Tag::ParameterContainer, *m_parameter_container);
XML::writeTaggedElement(w, Tag::BatchInfo, *m_batch_info);
XML::writeTaggedValue(w, Tag::Activity, m_activity);
// simulated data
if (m_simulated_data_item) {
XML::writeTaggedElement(w, Tag::SimulatedData, *m_simulated_data_item);
}
// real item
if (m_dfile_item) {
XML::writeTaggedElement(w, Tag::DatafileItem, *m_dfile_item);
}
// fit suite
if (m_fit_suite_item) {
XML::writeTaggedElement(w, Tag::FitSuite, *m_fit_suite_item);
}
}
void JobItem::readFrom(QXmlStreamReader* r)
{
while (r->readNextStartElement()) {
QString tag = r->name().toString();
if (tag == Tag::SimulationOptions)
XML::readTaggedElement(r, tag, *m_simulation_options_item);
else if (tag == Tag::Instrument)
XML::readTaggedElement(r, tag, m_instrument);
else if (tag == Tag::ParameterContainer) {
createParameterTree();
XML::readTaggedElement(r, tag, *m_parameter_container);
} else if (tag == Tag::Sample)
XML::readTaggedElement(r, tag, *m_sample_item);
else if (tag == Tag::Activity)
m_activity = XML::readTaggedString(r, tag);
else if (tag == Tag::BatchInfo)
XML::readTaggedElement(r, tag, *m_batch_info);
else if (tag == Tag::SimulatedData) {
createSimulatedDataItem();
XML::readTaggedElement(r, tag, *m_simulated_data_item);
} else if (tag == Tag::DatafileItem) {
m_dfile_item = std::make_unique<DatafileItem>();
m_dfile_item->readFrom(r);
createDiffDataItem()->alignXYranges(m_dfile_item->dataItem());
XML::gotoEndElementOfTag(r, tag);
} else if (tag == Tag::FitSuite)
XML::readTaggedElement(r, tag, *m_fit_suite_item);
else
r->skipCurrentElement();
}
}
void JobItem::saveDatafields(const QString& projectDir) const
{
if (m_dfile_item)
m_dfile_item->saveDatafield(projectDir);
if (m_simulated_data_item)
m_simulated_data_item->saveDatafield(projectDir);
}
void JobItem::loadDatafields(const QString& projectDir)
{
if (m_dfile_item)
m_dfile_item->loadDatafield(projectDir);
if (m_simulated_data_item)
m_simulated_data_item->loadDatafield(projectDir, rank());
}
//! Updates the name of file to store intensity data.
void JobItem::updateFileName()
{
if (DataItem* item = simulatedDataItem())
item->setFileName(GUI::Path::intensityDataFileName(batchInfo()->jobName(), "jobdata"));
if (m_dfile_item)
if (DataItem* item = m_dfile_item->dataItem())
item->setFileName(GUI::Path::intensityDataFileName(batchInfo()->jobName(), "refdata"));
}
void JobItem::initWorker()
{
ISimulation* simulation =
GUI::ToCore::itemsToSimulation(sampleItem(), instrumentItem(), simulationOptionsItem())
.release();
m_worker = std::make_unique<JobWorker>(simulation);
m_thread = std::make_unique<QThread>();
m_worker->moveToThread(m_thread.get());
connect(worker(), &JobWorker::started, this, &JobItem::onStartedJob);
connect(worker(), &JobWorker::progressUpdate, this, &JobItem::onItemProgress);
connect(worker(), &JobWorker::finished, this, &JobItem::onFinishedWork);
connect(thread(), &QThread::started, worker(), &JobWorker::start);
connect(thread(), &QThread::finished, this, &JobItem::onFinishedThread);
}
void JobItem::haltWorker()
{
if (!m_worker)
return;
m_worker->terminate();
}
void JobItem::onStartedJob()
{
batchInfo()->setProgress(0);
batchInfo()->setStatus(JobStatus::Running);
batchInfo()->setBeginTime(m_worker->simulationStart());
batchInfo()->setEndTime(QDateTime());
}
void JobItem::onItemProgress()
{
if (!worker())
return;
batchInfo()->setProgress(worker()->percentageDone());
emit progressIncremented();
}
void JobItem::onFinishedWork()
{
ASSERT(worker());
batchInfo()->setEndTime(worker()->simulationEnd());
// propagate status of runner
if (isFailed(worker()->workerStatus()))
batchInfo()->setComments(worker()->workerFailureMessage());
else {
batchInfo()->setComments("");
ASSERT(worker()->workerResult());
simulatedDataItem()->setDatafield(*worker()->workerResult());
updateFileName();
}
batchInfo()->setStatus(worker()->workerStatus());
// fix job progress (if job was successful, but due to wrong estimation, progress not 100%)
if (isCompleted(batchInfo()->status()))
batchInfo()->setProgress(100);
// tell the thread to exit here (instead of connecting JobRunner::finished
// to QThread::quit because of strange behaviour)
ASSERT(thread());
thread()->quit();
emit jobFinished(this);
worker()->disconnect();
m_worker.release();
}
void JobItem::onFinishedThread()
{
m_thread->deleteLater();
m_thread.release();
}
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