/**
* Determine the instrument from the various input parameters.
*
* @return The correct instrument.
*/
Instrument_const_sptr CreateChunkingFromInstrument::getInstrument() {
// try the input workspace
MatrixWorkspace_sptr inWS = getProperty(PARAM_IN_WKSP);
if (inWS) {
return inWS->getInstrument();
}
// temporary workspace to hang everything else off of
MatrixWorkspace_sptr tempWS(new Workspace2D());
// name of the instrument
string instName = getPropertyValue(PARAM_INST_NAME);
// see if there is an input file
string filename = getPropertyValue(PARAM_IN_FILE);
if (!filename.empty()) {
string top_entry_name("entry"); // TODO make more flexible
// get the instrument name from the filename
size_t n = filename.rfind('/');
if (n != std::string::npos) {
std::string temp = filename.substr(n + 1, filename.size() - n - 1);
n = temp.find('_');
if (n != std::string::npos && n > 0) {
instName = temp.substr(0, n);
}
}
// read information from the nexus file itself
try {
NeXus::File nxsfile(filename);
// get the run start time
string start_time;
nxsfile.openGroup(top_entry_name, "NXentry");
nxsfile.readData("start_time", start_time);
tempWS->mutableRun().addProperty(
"run_start", DateAndTime(start_time).toISO8601String(), true);
// get the instrument name
nxsfile.openGroup("instrument", "NXinstrument");
nxsfile.readData("name", instName);
nxsfile.closeGroup();
// Test if IDF exists in file, move on quickly if not
nxsfile.openPath("instrument/instrument_xml");
nxsfile.close();
IAlgorithm_sptr loadInst =
createChildAlgorithm("LoadIDFFromNexus", 0.0, 0.2);
// Now execute the Child Algorithm. Catch and log any error, but don't
// stop.
try {
loadInst->setPropertyValue("Filename", filename);
loadInst->setProperty<MatrixWorkspace_sptr>("Workspace", tempWS);
loadInst->setPropertyValue("InstrumentParentPath", top_entry_name);
loadInst->execute();
} catch (std::invalid_argument &) {
g_log.error("Invalid argument to LoadIDFFromNexus Child Algorithm ");
} catch (std::runtime_error &) {
g_log.debug("No instrument definition found in " + filename + " at " +
top_entry_name + "/instrument");
}
if (loadInst->isExecuted())
return tempWS->getInstrument();
else
g_log.information("No IDF loaded from Nexus file.");
} catch (::NeXus::Exception &) {
g_log.information("No instrument definition found in " + filename +
" at " + top_entry_name + "/instrument");
}
}
// run LoadInstrument if other methods have not run
string instFilename = getPropertyValue(PARAM_INST_FILE);
Algorithm_sptr childAlg = createChildAlgorithm("LoadInstrument", 0.0, 0.2);
childAlg->setProperty<MatrixWorkspace_sptr>("Workspace", tempWS);
childAlg->setPropertyValue("Filename", instFilename);
childAlg->setPropertyValue("InstrumentName", instName);
childAlg->executeAsChildAlg();
return tempWS->getInstrument();
}
/** Execute the algorithm.
*/
void LoadLiveData::exec() {
// The full, post-processed output workspace
m_outputWS = this->getProperty("OutputWorkspace");
// Validate inputs
if (this->hasPostProcessing()) {
if (this->getPropertyValue("AccumulationWorkspace").empty())
throw std::invalid_argument("Must specify the AccumulationWorkspace "
"parameter if using PostProcessing.");
// The accumulated but not post-processed output workspace
m_accumWS = this->getProperty("AccumulationWorkspace");
} else {
// No post-processing, so the accumulation and output are the same
m_accumWS = m_outputWS;
}
// Get or create the live listener
ILiveListener_sptr listener = this->getLiveListener();
// Do we need to reset the data?
bool dataReset = listener->dataReset();
// The listener returns a MatrixWorkspace containing the chunk of live data.
Workspace_sptr chunkWS;
bool dataNotYetGiven = true;
while (dataNotYetGiven) {
try {
chunkWS = listener->extractData();
dataNotYetGiven = false;
} catch (Exception::NotYet &ex) {
g_log.warning() << "The " << listener->name()
<< " is not ready to return data: " << ex.what() << "\n";
g_log.warning()
<< "Trying again in 10 seconds - cancel the algorithm to stop.\n";
const int tenSeconds = 40;
for (int i = 0; i < tenSeconds; ++i) {
Poco::Thread::sleep(10000 / tenSeconds); // 250 ms
this->interruption_point();
}
}
}
// TODO: Have the ILiveListener tell me exactly the time stamp
DateAndTime lastTimeStamp = DateAndTime::getCurrentTime();
this->setPropertyValue("LastTimeStamp", lastTimeStamp.toISO8601String());
// Now we process the chunk
Workspace_sptr processed = this->processChunk(chunkWS);
bool PreserveEvents = this->getProperty("PreserveEvents");
EventWorkspace_sptr processedEvent =
boost::dynamic_pointer_cast<EventWorkspace>(processed);
if (!PreserveEvents && processedEvent) {
// Convert the monitor workspace, if there is one and it's necessary
MatrixWorkspace_sptr monitorWS = processedEvent->monitorWorkspace();
auto monitorEventWS =
boost::dynamic_pointer_cast<EventWorkspace>(monitorWS);
if (monitorEventWS) {
auto monAlg = this->createChildAlgorithm("ConvertToMatrixWorkspace");
monAlg->setProperty("InputWorkspace", monitorEventWS);
monAlg->executeAsChildAlg();
if (!monAlg->isExecuted())
g_log.error(
"Failed to convert monitors from events to histogram form.");
monitorWS = monAlg->getProperty("OutputWorkspace");
}
// Now do the main workspace
Algorithm_sptr alg = this->createChildAlgorithm("ConvertToMatrixWorkspace");
alg->setProperty("InputWorkspace", processedEvent);
std::string outputName = "__anonymous_livedata_convert_" +
this->getPropertyValue("OutputWorkspace");
alg->setPropertyValue("OutputWorkspace", outputName);
alg->execute();
if (!alg->isExecuted())
throw std::runtime_error("Error when calling ConvertToMatrixWorkspace "
"(since PreserveEvents=False). See log.");
// Replace the "processed" workspace with the converted one.
MatrixWorkspace_sptr temp = alg->getProperty("OutputWorkspace");
if (monitorWS)
temp->setMonitorWorkspace(monitorWS); // Set back the monitor workspace
processed = temp;
}
// How do we accumulate the data?
std::string accum = this->getPropertyValue("AccumulationMethod");
// If the AccumulationWorkspace does not exist, we always replace the
// AccumulationWorkspace.
// Also, if the listener said we are resetting the data, then we clear out the
// old.
if (!m_accumWS || dataReset)
accum = "Replace";
g_log.notice() << "Performing the " << accum << " operation.\n";
// Perform the accumulation and set the AccumulationWorkspace workspace
if (accum == "Replace")
this->replaceChunk(processed);
else if (accum == "Append")
this->appendChunk(processed);
else
// Default to Add.
this->addChunk(processed);
// At this point, m_accumWS is set.
if (this->hasPostProcessing()) {
// ----------- Run post-processing -------------
this->runPostProcessing();
// Set both output workspaces
this->setProperty("AccumulationWorkspace", m_accumWS);
this->setProperty("OutputWorkspace", m_outputWS);
doSortEvents(m_outputWS);
} else {
// ----------- No post-processing -------------
m_outputWS = m_accumWS;
// We DO NOT set AccumulationWorkspace.
this->setProperty("OutputWorkspace", m_outputWS);
}
// Output group requires some additional handling
WorkspaceGroup_sptr out_gws =
boost::dynamic_pointer_cast<WorkspaceGroup>(m_outputWS);
if (out_gws) {
size_t n = static_cast<size_t>(out_gws->getNumberOfEntries());
for (size_t i = 0; i < n; ++i) {
auto ws = out_gws->getItem(i);
std::string itemName = ws->name();
std::string wsName =
getPropertyValue("OutputWorkspace") + "_" + std::to_string(i + 1);
if (wsName != itemName) {
if (AnalysisDataService::Instance().doesExist(itemName)) {
// replace the temporary name with the proper one
AnalysisDataService::Instance().rename(itemName, wsName);
}
} else {
// touch the workspace in the ADS to issue a notification to update the
// GUI
AnalysisDataService::Instance().addOrReplace(itemName, ws);
}
}
}
}
/** Process groups. Groups are processed differently depending on transmission
* runs and polarization analysis. If transmission run is a matrix workspace, it
* will be applied to each of the members in the input workspace group. If
* transmission run is a workspace group, the behaviour is different depending
* on polarization analysis. If polarization analysis is off (i.e.
* 'PolarizationAnalysis' is set to 'None') each item in the transmission group
* is associated with the corresponding item in the input workspace group. If
* polarization analysis is on (i.e. 'PolarizationAnalysis' is 'PA' or 'PNR')
* items in the transmission group will be summed to produce a matrix workspace
* that will be applied to each of the items in the input workspace group. See
* documentation of this algorithm for more details.
*/
bool ReflectometryReductionOneAuto2::processGroups() {
// this algorithm effectively behaves as MultiPeriodGroupAlgorithm
m_usingBaseProcessGroups = true;
// Get our input workspace group
auto group = AnalysisDataService::Instance().retrieveWS<WorkspaceGroup>(
getPropertyValue("InputWorkspace"));
// Get name of IvsQ workspace (native binning)
const std::string outputIvsQ = getPropertyValue("OutputWorkspace");
// Get name of IvsQ (native binning) workspace
const std::string outputIvsQBinned =
getPropertyValue("OutputWorkspaceBinned");
// Get name of IvsLam workspace
const std::string outputIvsLam =
getPropertyValue("OutputWorkspaceWavelength");
// Create a copy of ourselves
Algorithm_sptr alg =
createChildAlgorithm(name(), -1, -1, isLogging(), version());
alg->setChild(false);
alg->setRethrows(true);
// Copy all the non-workspace properties over
const std::vector<Property *> props = getProperties();
for (auto &prop : props) {
if (prop) {
IWorkspaceProperty *wsProp = dynamic_cast<IWorkspaceProperty *>(prop);
if (!wsProp)
alg->setPropertyValue(prop->name(), prop->value());
}
}
const bool polarizationAnalysisOn =
getPropertyValue("PolarizationAnalysis") != "None";
// Check if the transmission runs are groups or not
const std::string firstTrans = getPropertyValue("FirstTransmissionRun");
WorkspaceGroup_sptr firstTransG;
MatrixWorkspace_sptr firstTransSum;
if (!firstTrans.empty()) {
auto firstTransWS =
AnalysisDataService::Instance().retrieveWS<Workspace>(firstTrans);
firstTransG = boost::dynamic_pointer_cast<WorkspaceGroup>(firstTransWS);
if (!firstTransG) {
alg->setProperty("FirstTransmissionRun", firstTrans);
} else if (polarizationAnalysisOn) {
firstTransSum = sumTransmissionWorkspaces(firstTransG);
}
}
const std::string secondTrans = getPropertyValue("SecondTransmissionRun");
WorkspaceGroup_sptr secondTransG;
MatrixWorkspace_sptr secondTransSum;
if (!secondTrans.empty()) {
auto secondTransWS =
AnalysisDataService::Instance().retrieveWS<Workspace>(secondTrans);
secondTransG = boost::dynamic_pointer_cast<WorkspaceGroup>(secondTransWS);
if (!secondTransG) {
alg->setProperty("SecondTransmissionRun", secondTrans);
} else if (polarizationAnalysisOn) {
secondTransSum = sumTransmissionWorkspaces(secondTransG);
}
}
std::vector<std::string> IvsQGroup, IvsQUnbinnedGroup, IvsLamGroup;
// Execute algorithm over each group member
for (size_t i = 0; i < group->size(); ++i) {
const std::string IvsQName = outputIvsQ + "_" + std::to_string(i + 1);
const std::string IvsQBinnedName =
outputIvsQBinned + "_" + std::to_string(i + 1);
const std::string IvsLamName = outputIvsLam + "_" + std::to_string(i + 1);
if (firstTransG) {
if (!polarizationAnalysisOn)
alg->setProperty("FirstTransmissionRun",
firstTransG->getItem(i)->getName());
else
alg->setProperty("FirstTransmissionRun", firstTransSum);
}
if (secondTransG) {
if (!polarizationAnalysisOn)
alg->setProperty("SecondTransmissionRun",
secondTransG->getItem(i)->getName());
else
alg->setProperty("SecondTransmissionRun", secondTransSum);
}
alg->setProperty("InputWorkspace", group->getItem(i)->getName());
alg->setProperty("OutputWorkspace", IvsQName);
alg->setProperty("OutputWorkspaceBinned", IvsQBinnedName);
alg->setProperty("OutputWorkspaceWavelength", IvsLamName);
alg->execute();
IvsQGroup.push_back(IvsQName);
IvsQUnbinnedGroup.push_back(IvsQBinnedName);
IvsLamGroup.push_back(IvsLamName);
}
// Group the IvsQ and IvsLam workspaces
Algorithm_sptr groupAlg = createChildAlgorithm("GroupWorkspaces");
groupAlg->setChild(false);
groupAlg->setRethrows(true);
groupAlg->setProperty("InputWorkspaces", IvsLamGroup);
groupAlg->setProperty("OutputWorkspace", outputIvsLam);
groupAlg->execute();
groupAlg->setProperty("InputWorkspaces", IvsQGroup);
groupAlg->setProperty("OutputWorkspace", outputIvsQ);
groupAlg->execute();
groupAlg->setProperty("InputWorkspaces", IvsQUnbinnedGroup);
groupAlg->setProperty("OutputWorkspace", outputIvsQBinned);
groupAlg->execute();
// Set other properties so they can be updated in the Reflectometry interface
setPropertyValue("ThetaIn", alg->getPropertyValue("ThetaIn"));
setPropertyValue("MomentumTransferMin",
alg->getPropertyValue("MomentumTransferMin"));
setPropertyValue("MomentumTransferMax",
alg->getPropertyValue("MomentumTransferMax"));
setPropertyValue("MomentumTransferStep",
alg->getPropertyValue("MomentumTransferStep"));
setPropertyValue("ScaleFactor", alg->getPropertyValue("ScaleFactor"));
if (!polarizationAnalysisOn) {
// No polarization analysis. Reduction stops here
setPropertyValue("OutputWorkspace", outputIvsQ);
setPropertyValue("OutputWorkspaceBinned", outputIvsQBinned);
setPropertyValue("OutputWorkspaceWavelength", outputIvsLam);
return true;
}
if (!group->isMultiperiod()) {
g_log.warning("Polarization corrections can only be performed on "
"multiperiod workspaces.");
setPropertyValue("OutputWorkspace", outputIvsQ);
setPropertyValue("OutputWorkspaceBinned", outputIvsQBinned);
setPropertyValue("OutputWorkspaceWavelength", outputIvsLam);
return true;
}
Algorithm_sptr polAlg = createChildAlgorithm("PolarizationCorrection");
polAlg->setChild(false);
polAlg->setRethrows(true);
polAlg->setProperty("InputWorkspace", outputIvsLam);
polAlg->setProperty("OutputWorkspace", outputIvsLam);
polAlg->setProperty("PolarizationAnalysis",
getPropertyValue("PolarizationAnalysis"));
polAlg->setProperty("CPp", getPropertyValue("CPp"));
polAlg->setProperty("CRho", getPropertyValue("CRho"));
polAlg->setProperty("CAp", getPropertyValue("CAp"));
polAlg->setProperty("CAlpha", getPropertyValue("CAlpha"));
polAlg->execute();
// Now we've overwritten the IvsLam workspaces, we'll need to recalculate
// the IvsQ ones
alg->setProperty("FirstTransmissionRun", "");
alg->setProperty("SecondTransmissionRun", "");
alg->setProperty("CorrectionAlgorithm", "None");
alg->setProperty("ThetaIn", Mantid::EMPTY_DBL());
alg->setProperty("ProcessingInstructions", "0");
for (size_t i = 0; i < group->size(); ++i) {
const std::string IvsQName = outputIvsQ + "_" + std::to_string(i + 1);
const std::string IvsQBinnedName =
outputIvsQBinned + "_" + std::to_string(i + 1);
const std::string IvsLamName = outputIvsLam + "_" + std::to_string(i + 1);
alg->setProperty("InputWorkspace", IvsLamName);
alg->setProperty("OutputWorkspace", IvsQName);
alg->setProperty("OutputWorkspaceBinned", IvsQBinnedName);
alg->setProperty("OutputWorkspaceWavelength", IvsLamName);
alg->execute();
}
setPropertyValue("OutputWorkspace", outputIvsQ);
setPropertyValue("OutputWorkspaceBinned", outputIvsQBinned);
setPropertyValue("OutputWorkspaceWavelength", outputIvsLam);
return true;
}
/*
Executes the underlying algorithm to create the MVP model.
@param factory : visualisation factory to use.
@param loadingProgressUpdate : Handler for GUI updates while algorithm
progresses.
@param drawingProgressUpdate : Handler for GUI updates while
vtkDataSetFactory::create occurs.
*/
vtkSmartPointer<vtkDataSet>
EventNexusLoadingPresenter::execute(vtkDataSetFactory *factory,
ProgressAction &loadingProgressUpdate,
ProgressAction &drawingProgressUpdate) {
using namespace Mantid::API;
using namespace Mantid::Geometry;
this->m_view->getLoadInMemory(); // TODO, nexus reader algorithm currently has
// no use of this.
if (this->shouldLoad()) {
Poco::NObserver<ProgressAction,
Mantid::API::Algorithm::ProgressNotification>
observer(loadingProgressUpdate, &ProgressAction::handler);
AnalysisDataService::Instance().remove("MD_EVENT_WS_ID");
Algorithm_sptr loadAlg =
AlgorithmManager::Instance().createUnmanaged("LoadEventNexus");
loadAlg->initialize();
loadAlg->setChild(true);
loadAlg->setPropertyValue("Filename", this->m_filename);
loadAlg->setPropertyValue("OutputWorkspace", "temp_ws");
loadAlg->addObserver(observer);
loadAlg->executeAsChildAlg();
loadAlg->removeObserver(observer);
Workspace_sptr temp = loadAlg->getProperty("OutputWorkspace");
IEventWorkspace_sptr tempWS =
boost::dynamic_pointer_cast<IEventWorkspace>(temp);
Algorithm_sptr convertAlg = AlgorithmManager::Instance().createUnmanaged(
"ConvertToDiffractionMDWorkspace", 1);
convertAlg->initialize();
convertAlg->setChild(true);
convertAlg->setProperty("InputWorkspace", tempWS);
convertAlg->setProperty<bool>("ClearInputWorkspace", false);
convertAlg->setProperty<bool>("LorentzCorrection", true);
convertAlg->setPropertyValue("OutputWorkspace", "converted_ws");
convertAlg->addObserver(observer);
convertAlg->executeAsChildAlg();
convertAlg->removeObserver(observer);
IMDEventWorkspace_sptr outWS = convertAlg->getProperty("OutputWorkspace");
AnalysisDataService::Instance().addOrReplace("MD_EVENT_WS_ID", outWS);
}
Workspace_sptr result =
AnalysisDataService::Instance().retrieve("MD_EVENT_WS_ID");
Mantid::API::IMDEventWorkspace_sptr eventWs =
boost::dynamic_pointer_cast<Mantid::API::IMDEventWorkspace>(result);
m_wsTypeName = eventWs->id();
factory->setRecursionDepth(this->m_view->getRecursionDepth());
auto visualDataSet = factory->oneStepCreate(
eventWs, drawingProgressUpdate); // HACK: progressUpdate should be
// argument for drawing!
this->extractMetadata(*eventWs);
this->appendMetadata(visualDataSet, eventWs->getName());
return visualDataSet;
}
bool ReflectometryReductionOneAuto::processGroups() {
auto group = AnalysisDataService::Instance().retrieveWS<WorkspaceGroup>(
getPropertyValue("InputWorkspace"));
const std::string outputIvsQ = this->getPropertyValue("OutputWorkspace");
const std::string outputIvsLam =
this->getPropertyValue("OutputWorkspaceWavelength");
// Create a copy of ourselves
Algorithm_sptr alg = this->createChildAlgorithm(
this->name(), -1, -1, this->isLogging(), this->version());
alg->setChild(false);
alg->setRethrows(true);
// Copy all the non-workspace properties over
std::vector<Property *> props = this->getProperties();
for (auto prop = props.begin(); prop != props.end(); ++prop) {
if (*prop) {
IWorkspaceProperty *wsProp = dynamic_cast<IWorkspaceProperty *>(*prop);
if (!wsProp)
alg->setPropertyValue((*prop)->name(), (*prop)->value());
}
}
// Check if the transmission runs are groups or not
const std::string firstTrans = this->getPropertyValue("FirstTransmissionRun");
WorkspaceGroup_sptr firstTransG;
if (!firstTrans.empty()) {
auto firstTransWS =
AnalysisDataService::Instance().retrieveWS<Workspace>(firstTrans);
firstTransG = boost::dynamic_pointer_cast<WorkspaceGroup>(firstTransWS);
if (!firstTransG)
alg->setProperty("FirstTransmissionRun", firstTrans);
else if (group->size() != firstTransG->size())
throw std::runtime_error("FirstTransmissionRun WorkspaceGroup must be "
"the same size as the InputWorkspace "
"WorkspaceGroup");
}
const std::string secondTrans =
this->getPropertyValue("SecondTransmissionRun");
WorkspaceGroup_sptr secondTransG;
if (!secondTrans.empty()) {
auto secondTransWS =
AnalysisDataService::Instance().retrieveWS<Workspace>(secondTrans);
secondTransG = boost::dynamic_pointer_cast<WorkspaceGroup>(secondTransWS);
if (!secondTransG)
alg->setProperty("SecondTransmissionRun", secondTrans);
else if (group->size() != secondTransG->size())
throw std::runtime_error("SecondTransmissionRun WorkspaceGroup must be "
"the same size as the InputWorkspace "
"WorkspaceGroup");
}
std::vector<std::string> IvsQGroup, IvsLamGroup;
// Execute algorithm over each group member (or period, if this is
// multiperiod)
size_t numMembers = group->size();
for (size_t i = 0; i < numMembers; ++i) {
const std::string IvsQName =
outputIvsQ + "_" + boost::lexical_cast<std::string>(i + 1);
const std::string IvsLamName =
outputIvsLam + "_" + boost::lexical_cast<std::string>(i + 1);
alg->setProperty("InputWorkspace", group->getItem(i)->name());
alg->setProperty("OutputWorkspace", IvsQName);
alg->setProperty("OutputWorkspaceWavelength", IvsLamName);
// Handle transmission runs
if (firstTransG)
alg->setProperty("FirstTransmissionRun", firstTransG->getItem(i)->name());
if (secondTransG)
alg->setProperty("SecondTransmissionRun",
secondTransG->getItem(i)->name());
alg->execute();
IvsQGroup.push_back(IvsQName);
IvsLamGroup.push_back(IvsLamName);
// We use the first group member for our thetaout value
if (i == 0)
this->setPropertyValue("ThetaOut", alg->getPropertyValue("ThetaOut"));
}
// Group the IvsQ and IvsLam workspaces
Algorithm_sptr groupAlg = this->createChildAlgorithm("GroupWorkspaces");
groupAlg->setChild(false);
groupAlg->setRethrows(true);
groupAlg->setProperty("InputWorkspaces", IvsLamGroup);
groupAlg->setProperty("OutputWorkspace", outputIvsLam);
groupAlg->execute();
groupAlg->setProperty("InputWorkspaces", IvsQGroup);
groupAlg->setProperty("OutputWorkspace", outputIvsQ);
groupAlg->execute();
// If this is a multiperiod workspace and we have polarization corrections
// enabled
if (this->getPropertyValue("PolarizationAnalysis") !=
noPolarizationCorrectionMode()) {
if (group->isMultiperiod()) {
// Perform polarization correction over the IvsLam group
Algorithm_sptr polAlg =
this->createChildAlgorithm("PolarizationCorrection");
polAlg->setChild(false);
polAlg->setRethrows(true);
polAlg->setProperty("InputWorkspace", outputIvsLam);
polAlg->setProperty("OutputWorkspace", outputIvsLam);
polAlg->setProperty("PolarizationAnalysis",
this->getPropertyValue("PolarizationAnalysis"));
polAlg->setProperty("CPp", this->getPropertyValue(cppLabel()));
polAlg->setProperty("CRho", this->getPropertyValue(crhoLabel()));
polAlg->setProperty("CAp", this->getPropertyValue(cApLabel()));
polAlg->setProperty("CAlpha", this->getPropertyValue(cAlphaLabel()));
polAlg->execute();
// Now we've overwritten the IvsLam workspaces, we'll need to recalculate
// the IvsQ ones
alg->setProperty("FirstTransmissionRun", "");
alg->setProperty("SecondTransmissionRun", "");
for (size_t i = 0; i < numMembers; ++i) {
const std::string IvsQName =
outputIvsQ + "_" + boost::lexical_cast<std::string>(i + 1);
const std::string IvsLamName =
outputIvsLam + "_" + boost::lexical_cast<std::string>(i + 1);
alg->setProperty("InputWorkspace", IvsLamName);
alg->setProperty("OutputWorkspace", IvsQName);
alg->setProperty("OutputWorkspaceWavelength", IvsLamName);
alg->execute();
}
} else {
g_log.warning("Polarization corrections can only be performed on "
"multiperiod workspaces.");
}
}
// We finished successfully
this->setPropertyValue("OutputWorkspace", outputIvsQ);
this->setPropertyValue("OutputWorkspaceWavelength", outputIvsLam);
setExecuted(true);
notificationCenter().postNotification(
new FinishedNotification(this, isExecuted()));
return true;
}
bool ReflectometryReductionOneAuto::processGroups() {
// isPolarizationCorrectionOn is used to decide whether
// we should process our Transmission WorkspaceGroup members
// as individuals (not multiperiod) when PolarizationCorrection is off,
// or sum over all of the workspaces in the group
// and used that sum as our TransmissionWorkspace when PolarizationCorrection
// is on.
const bool isPolarizationCorrectionOn =
this->getPropertyValue("PolarizationAnalysis") !=
noPolarizationCorrectionMode();
// Get our input workspace group
auto group = AnalysisDataService::Instance().retrieveWS<WorkspaceGroup>(
getPropertyValue("InputWorkspace"));
// Get name of IvsQ workspace
const std::string outputIvsQ = this->getPropertyValue("OutputWorkspace");
// Get name of IvsLam workspace
const std::string outputIvsLam =
this->getPropertyValue("OutputWorkspaceWavelength");
// Create a copy of ourselves
Algorithm_sptr alg = this->createChildAlgorithm(
this->name(), -1, -1, this->isLogging(), this->version());
alg->setChild(false);
alg->setRethrows(true);
// Copy all the non-workspace properties over
std::vector<Property *> props = this->getProperties();
for (auto &prop : props) {
if (prop) {
IWorkspaceProperty *wsProp = dynamic_cast<IWorkspaceProperty *>(prop);
if (!wsProp)
alg->setPropertyValue(prop->name(), prop->value());
}
}
// Check if the transmission runs are groups or not
const std::string firstTrans = this->getPropertyValue("FirstTransmissionRun");
WorkspaceGroup_sptr firstTransG;
if (!firstTrans.empty()) {
auto firstTransWS =
AnalysisDataService::Instance().retrieveWS<Workspace>(firstTrans);
firstTransG = boost::dynamic_pointer_cast<WorkspaceGroup>(firstTransWS);
if (!firstTransG) {
// we only have one transmission workspace, so we use it as it is.
alg->setProperty("FirstTransmissionRun", firstTrans);
} else if (group->size() != firstTransG->size() &&
!isPolarizationCorrectionOn) {
// if they are not the same size then we cannot associate a transmission
// group workspace member with every input group workpspace member.
throw std::runtime_error("FirstTransmissionRun WorkspaceGroup must be "
"the same size as the InputWorkspace "
"WorkspaceGroup");
}
}
const std::string secondTrans =
this->getPropertyValue("SecondTransmissionRun");
WorkspaceGroup_sptr secondTransG;
if (!secondTrans.empty()) {
auto secondTransWS =
AnalysisDataService::Instance().retrieveWS<Workspace>(secondTrans);
secondTransG = boost::dynamic_pointer_cast<WorkspaceGroup>(secondTransWS);
if (!secondTransG)
// we only have one transmission workspace, so we use it as it is.
alg->setProperty("SecondTransmissionRun", secondTrans);
else if (group->size() != secondTransG->size() &&
!isPolarizationCorrectionOn) {
// if they are not the same size then we cannot associate a transmission
// group workspace member with every input group workpspace member.
throw std::runtime_error("SecondTransmissionRun WorkspaceGroup must be "
"the same size as the InputWorkspace "
"WorkspaceGroup");
}
}
std::vector<std::string> IvsQGroup, IvsLamGroup;
// Execute algorithm over each group member (or period, if this is
// multiperiod)
size_t numMembers = group->size();
for (size_t i = 0; i < numMembers; ++i) {
const std::string IvsQName =
outputIvsQ + "_" + boost::lexical_cast<std::string>(i + 1);
const std::string IvsLamName =
outputIvsLam + "_" + boost::lexical_cast<std::string>(i + 1);
// If our transmission run is a group and PolarizationCorrection is on
// then we sum our transmission group members.
//
// This is done inside of the for loop to avoid the wrong workspace being
// used when these arguments are passed through to the exec() method.
// If this is not set in the loop, exec() will fetch the first workspace
// from the specified Transmission Group workspace that the user entered.
if (firstTransG && isPolarizationCorrectionOn) {
auto firstTransmissionSum = sumOverTransmissionGroup(firstTransG);
alg->setProperty("FirstTransmissionRun", firstTransmissionSum);
}
if (secondTransG && isPolarizationCorrectionOn) {
auto secondTransmissionSum = sumOverTransmissionGroup(secondTransG);
alg->setProperty("SecondTransmissionRun", secondTransmissionSum);
}
// Otherwise, if polarization correction is off, we process them
// using one transmission group member at a time.
if (firstTransG && !isPolarizationCorrectionOn) // polarization off
alg->setProperty("FirstTransmissionRun", firstTransG->getItem(i)->name());
if (secondTransG && !isPolarizationCorrectionOn) // polarization off
alg->setProperty("SecondTransmissionRun",
secondTransG->getItem(i)->name());
alg->setProperty("InputWorkspace", group->getItem(i)->name());
alg->setProperty("OutputWorkspace", IvsQName);
alg->setProperty("OutputWorkspaceWavelength", IvsLamName);
alg->execute();
MatrixWorkspace_sptr tempFirstTransWS =
alg->getProperty("FirstTransmissionRun");
IvsQGroup.push_back(IvsQName);
IvsLamGroup.push_back(IvsLamName);
// We use the first group member for our thetaout value
if (i == 0)
this->setPropertyValue("ThetaOut", alg->getPropertyValue("ThetaOut"));
}
// Group the IvsQ and IvsLam workspaces
Algorithm_sptr groupAlg = this->createChildAlgorithm("GroupWorkspaces");
groupAlg->setChild(false);
groupAlg->setRethrows(true);
groupAlg->setProperty("InputWorkspaces", IvsLamGroup);
groupAlg->setProperty("OutputWorkspace", outputIvsLam);
groupAlg->execute();
groupAlg->setProperty("InputWorkspaces", IvsQGroup);
groupAlg->setProperty("OutputWorkspace", outputIvsQ);
groupAlg->execute();
// If this is a multiperiod workspace and we have polarization corrections
// enabled
if (isPolarizationCorrectionOn) {
if (group->isMultiperiod()) {
// Perform polarization correction over the IvsLam group
Algorithm_sptr polAlg =
this->createChildAlgorithm("PolarizationCorrection");
polAlg->setChild(false);
polAlg->setRethrows(true);
polAlg->setProperty("InputWorkspace", outputIvsLam);
polAlg->setProperty("OutputWorkspace", outputIvsLam);
polAlg->setProperty("PolarizationAnalysis",
this->getPropertyValue("PolarizationAnalysis"));
polAlg->setProperty("CPp", this->getPropertyValue(cppLabel()));
polAlg->setProperty("CRho", this->getPropertyValue(crhoLabel()));
polAlg->setProperty("CAp", this->getPropertyValue(cApLabel()));
polAlg->setProperty("CAlpha", this->getPropertyValue(cAlphaLabel()));
polAlg->execute();
// Now we've overwritten the IvsLam workspaces, we'll need to recalculate
// the IvsQ ones
alg->setProperty("FirstTransmissionRun", "");
alg->setProperty("SecondTransmissionRun", "");
for (size_t i = 0; i < numMembers; ++i) {
const std::string IvsQName =
outputIvsQ + "_" + boost::lexical_cast<std::string>(i + 1);
const std::string IvsLamName =
outputIvsLam + "_" + boost::lexical_cast<std::string>(i + 1);
alg->setProperty("InputWorkspace", IvsLamName);
alg->setProperty("OutputWorkspace", IvsQName);
alg->setProperty("CorrectionAlgorithm", "None");
alg->setProperty("OutputWorkspaceWavelength", IvsLamName);
alg->execute();
}
} else {
g_log.warning("Polarization corrections can only be performed on "
"multiperiod workspaces.");
}
}
// We finished successfully
this->setPropertyValue("OutputWorkspace", outputIvsQ);
this->setPropertyValue("OutputWorkspaceWavelength", outputIvsLam);
setExecuted(true);
notificationCenter().postNotification(
new FinishedNotification(this, isExecuted()));
return true;
}
/** Execute the algorithm.
*/
void CreateGroupingWorkspace::exec() {
MatrixWorkspace_sptr inWS = getProperty("InputWorkspace");
std::string InstrumentName = getPropertyValue("InstrumentName");
std::string InstrumentFilename = getPropertyValue("InstrumentFilename");
std::string OldCalFilename = getPropertyValue("OldCalFilename");
std::string GroupNames = getPropertyValue("GroupNames");
std::string grouping = getPropertyValue("GroupDetectorsBy");
int numGroups = getProperty("FixedGroupCount");
std::string componentName = getPropertyValue("ComponentName");
// Some validation
int numParams = 0;
if (inWS)
numParams++;
if (!InstrumentName.empty())
numParams++;
if (!InstrumentFilename.empty())
numParams++;
if (numParams > 1)
throw std::invalid_argument("You must specify exactly ONE way to get an "
"instrument (workspace, instrument name, or "
"IDF file). You specified more than one.");
if (numParams == 0)
throw std::invalid_argument("You must specify exactly ONE way to get an "
"instrument (workspace, instrument name, or "
"IDF file). You specified none.");
if (!OldCalFilename.empty() && !GroupNames.empty())
throw std::invalid_argument("You must specify either to use the "
"OldCalFilename parameter OR GroupNames but "
"not both!");
bool sortnames = false;
// ---------- Get the instrument one of 3 ways ---------------------------
Instrument_const_sptr inst;
if (inWS) {
inst = inWS->getInstrument();
} else {
Algorithm_sptr childAlg = createChildAlgorithm("LoadInstrument", 0.0, 0.2);
MatrixWorkspace_sptr tempWS = boost::make_shared<Workspace2D>();
childAlg->setProperty<MatrixWorkspace_sptr>("Workspace", tempWS);
childAlg->setPropertyValue("Filename", InstrumentFilename);
childAlg->setProperty("RewriteSpectraMap",
Mantid::Kernel::OptionalBool(true));
childAlg->setPropertyValue("InstrumentName", InstrumentName);
childAlg->executeAsChildAlg();
inst = tempWS->getInstrument();
}
if (GroupNames.empty() && OldCalFilename.empty()) {
if (grouping.compare("All") == 0) {
GroupNames = inst->getName();
} else if (inst->getName().compare("SNAP") == 0 &&
grouping.compare("Group") == 0) {
GroupNames = "East,West";
} else {
sortnames = true;
GroupNames = "";
int maxRecurseDepth = this->getProperty("MaxRecursionDepth");
// cppcheck-suppress syntaxError
PRAGMA_OMP(parallel for schedule(dynamic, 1) )
for (int num = 0; num < 300; ++num) {
PARALLEL_START_INTERUPT_REGION
std::ostringstream mess;
mess << grouping << num;
IComponent_const_sptr comp =
inst->getComponentByName(mess.str(), maxRecurseDepth);
PARALLEL_CRITICAL(GroupNames)
if (comp)
GroupNames += mess.str() + ",";
PARALLEL_END_INTERUPT_REGION
}
PARALLEL_CHECK_INTERUPT_REGION
}
}
// --------------------------- Create the output --------------------------
auto outWS = boost::make_shared<GroupingWorkspace>(inst);
this->setProperty("OutputWorkspace", outWS);
// This will get the grouping
std::map<detid_t, int> detIDtoGroup;
Progress prog(this, 0.2, 1.0, outWS->getNumberHistograms());
// Make the grouping one of three ways:
if (!GroupNames.empty())
detIDtoGroup = makeGroupingByNames(GroupNames, inst, prog, sortnames);
else if (!OldCalFilename.empty())
detIDtoGroup = readGroupingFile(OldCalFilename, prog);
else if ((numGroups > 0) && !componentName.empty())
detIDtoGroup =
makeGroupingByNumGroups(componentName, numGroups, inst, prog);
g_log.information() << detIDtoGroup.size()
<< " entries in the detectorID-to-group map.\n";
setProperty("NumberGroupedSpectraResult",
static_cast<int>(detIDtoGroup.size()));
if (detIDtoGroup.empty()) {
g_log.warning() << "Creating empty group workspace\n";
setProperty("NumberGroupsResult", static_cast<int>(0));
} else {
size_t numNotFound = 0;
// Make the groups, if any
std::map<detid_t, int>::const_iterator it_end = detIDtoGroup.end();
std::map<detid_t, int>::const_iterator it;
std::unordered_set<int> groupCount;
for (it = detIDtoGroup.begin(); it != it_end; ++it) {
int detID = it->first;
int group = it->second;
groupCount.insert(group);
try {
outWS->setValue(detID, double(group));
} catch (std::invalid_argument &) {
numNotFound++;
}
}
setProperty("NumberGroupsResult", static_cast<int>(groupCount.size()));
if (numNotFound > 0)
g_log.warning() << numNotFound << " detector IDs (out of "
<< detIDtoGroup.size()
<< ") were not found in the instrument\n.";
}
}
