diff --git a/.readthedocs.yaml b/.readthedocs.yaml index 94a3f52d4..dd3032114 100644 --- a/.readthedocs.yaml +++ b/.readthedocs.yaml @@ -21,7 +21,7 @@ build: # Install the package in editable mode using pixi - $HOME/.pixi/bin/pixi run --environment docs pip install -e . # Install docs dependencies in the RTD Python environment too - - pip install erdantic versioningit sphinx_rtd_theme sphinxcontrib-mermaid types-pyyaml h5py numpy matplotlib ruamel.yaml + - pip install erdantic versioningit sphinx_rtd_theme sphinxcontrib-mermaid types-pyyaml h5py numpy matplotlib ruamel.yaml==0.18.16 sphinx: builder: html diff --git a/pixi.lock b/pixi.lock index ad7dc05ff..e76550c7a 100644 --- a/pixi.lock +++ b/pixi.lock @@ -24,7 +24,7 @@ environments: - conda: https://conda.anaconda.org/conda-forge/noarch/aiosignal-1.4.0-pyhd8ed1ab_0.conda - conda: https://conda.anaconda.org/conda-forge/noarch/alabaster-1.0.0-pyhd8ed1ab_1.conda - conda: https://conda.anaconda.org/conda-forge/linux-64/alsa-lib-1.2.14-hb9d3cd8_0.conda - 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-from pydantic import BaseModel +from pydantic import BaseModel, ConfigDict from snapred.backend.dao.state.FocusGroup import FocusGroup +from snapred.meta.mantid.WorkspaceNameGenerator import WorkspaceName class FocusSpectraRequest(BaseModel): @@ -13,4 +12,7 @@ class FocusSpectraRequest(BaseModel): inputWorkspace: str groupingWorkspace: str - outputWorkspace: Optional[str] = None + maskWorkspace: WorkspaceName | None = None + outputWorkspace: WorkspaceName | None = None + + model_config = ConfigDict(arbitrary_types_allowed=True) diff --git a/src/snapred/backend/data/GroceryService.py b/src/snapred/backend/data/GroceryService.py index ef49e7853..9fd53c109 100644 --- a/src/snapred/backend/data/GroceryService.py +++ b/src/snapred/backend/data/GroceryService.py @@ -1515,6 +1515,36 @@ def fetchGroceryList(self, groceryList: Iterable[GroceryListItem]) -> List[Works return groceries + def combinePixelMasks(self, outputMaskWsName: WorkspaceName, masks2Combine: List[WorkspaceName]): + if not masks2Combine: + raise ValueError("Internal Error: Lists of masks to combine is empty") + + if not self.mantidSnapper.mtd.doesExist(outputMaskWsName): + raise ValueError( + ( + "Internal Error: outputMaskWs should exist before attempting to combine masks with it. " + "Consider using fetchCompatiblePixelMask to generate it." + ) + ) + + for maskWsName in masks2Combine: + if maskWsName == outputMaskWsName: + continue + if not self.mantidSnapper.mtd.doesExist(maskWsName): + raise ValueError( + f"Mask {maskWsName} of mask set {masks2Combine} does not exist, cannot combine into pixel mask." + ) + self.mantidSnapper.BinaryOperateMasks( + f"combine from pixel mask: '{maskWsName}'...", + InputWorkspace1=outputMaskWsName, + InputWorkspace2=maskWsName, + OperationType="OR", + OutputWorkspace=outputMaskWsName, + ) + + self.mantidSnapper.executeQueue() + return outputMaskWsName + def fetchGroceryDict(self, groceryDict: Dict[str, GroceryListItem], **kwargs) -> Dict[str, WorkspaceName]: """ This is the primary method you should use for fetching groceries, in almost all cases. diff --git a/src/snapred/backend/recipe/CalculateDiffCalResidualRecipe.py b/src/snapred/backend/recipe/CalculateDiffCalResidualRecipe.py index f54327fbb..42ef12b7a 100644 --- a/src/snapred/backend/recipe/CalculateDiffCalResidualRecipe.py +++ b/src/snapred/backend/recipe/CalculateDiffCalResidualRecipe.py @@ -66,7 +66,6 @@ def queueAlgos(self): # Step 2: Check for overlapping spectra and manage them fitPeaksWorkspace = self.mantidSnapper.mtd[self.fitPeaksDiagnosticWorkspaceName] numHistograms = fitPeaksWorkspace.getNumberHistograms() - processedSpectra = [] spectrumDict = {} for i in range(numHistograms): @@ -102,9 +101,7 @@ def queueAlgos(self): spectrumDict[spectrumId] = singleSpectrumName - # Append the processed spectrum to the list - processedSpectra.append(singleSpectrumName) - + processedSpectra = list(spectrumDict.values()) # Step 3: Combine all processed spectra into a single workspace combinedWorkspace = processedSpectra[0] for spectrum in processedSpectra[1:]: diff --git a/src/snapred/backend/recipe/GroupDiffCalRecipe.py b/src/snapred/backend/recipe/GroupDiffCalRecipe.py index 8b781e86e..e731e1241 100644 --- a/src/snapred/backend/recipe/GroupDiffCalRecipe.py +++ b/src/snapred/backend/recipe/GroupDiffCalRecipe.py @@ -77,7 +77,7 @@ def validateInputs(self, ingredients: Ingredients, groceries: Dict[str, Workspac ) diffocWS = self.mantidSnapper.mtd[groceries["groupingWorkspace"]] - if groupIDs != diffocWS.getGroupIDs().tolist(): + if not set(groupIDs).issubset(set(diffocWS.getGroupIDs().tolist())): raise RuntimeError( f"Group IDs do not match between peak list and focus WS: '{groupIDs}' vs. '{diffocWS.getGroupIDs()}'" ) diff --git a/src/snapred/backend/recipe/PixelDiffCalRecipe.py b/src/snapred/backend/recipe/PixelDiffCalRecipe.py index 7255b0494..891db08c5 100644 --- a/src/snapred/backend/recipe/PixelDiffCalRecipe.py +++ b/src/snapred/backend/recipe/PixelDiffCalRecipe.py @@ -1,15 +1,16 @@ from typing import Any, Dict, List, Set import numpy as np -from pydantic import BaseModel +from pydantic import BaseModel, ConfigDict from snapred.backend.dao.ingredients import DiffractionCalibrationIngredients as Ingredients from snapred.backend.log.logger import snapredLogger from snapred.backend.profiling.ProgressRecorder import ComputationalOrder, WallClockTime from snapred.backend.recipe.algorithm.Utensils import Utensils -from snapred.backend.recipe.Recipe import Recipe, WorkspaceName +from snapred.backend.recipe.Recipe import Recipe from snapred.meta.Config import Config from snapred.meta.decorators.classproperty import classproperty +from snapred.meta.mantid.WorkspaceNameGenerator import WorkspaceName from snapred.meta.mantid.WorkspaceNameGenerator import WorkspaceNameGenerator as wng logger = snapredLogger.getLogger(__name__) @@ -18,10 +19,12 @@ class PixelDiffCalServing(BaseModel): result: bool medianOffsets: List[float] - maskWorkspace: str + maskWorkspace: WorkspaceName | None = None calibrationTable: str outputWorkspace: str + model_config = ConfigDict(arbitrary_types_allowed=True) + # Decorating with the `WallClockTime` profiler here somewhat duplicates the objective of the decoration # at `CalibrationService.pixelCalibration`. However, by default, there will be no logging output from this instance. @@ -101,11 +104,20 @@ def unbagGroceries(self, groceries: Dict[str, WorkspaceName]) -> None: # noqa A """ self.wsTOF = groceries["inputWorkspace"] self.groupingWS = groceries["groupingWorkspace"] - self.maskWS = groceries["maskWorkspace"] + self.maskWS = groceries.get("maskWorkspace") # the name of the output calibration table self.DIFCpixel = groceries["calibrationTable"] self.DIFCprev = groceries.get("previousCalibration", "") # the input data converted to d-spacing + + if self.maskWS and self.mantidSnapper.mtd.doesExist(self.maskWS): + # if user supplied mask exists, apply it + # A user mask may not exist, but the maskws name is used to store + # the mask generated as part of PixelDiffCalRecipe + self.mantidSnapper.MaskDetectors( + "applying user generated mask", Workspace=self.wsTOF, MaskedWorkspace=self.maskWS + ) + self.wsDSP = wng.diffCalInputDSP().runNumber(self.runNumber).build() self.convertUnitsAndRebin(self.wsTOF, self.wsDSP) self.mantidSnapper.CloneWorkspace( @@ -215,11 +227,14 @@ def queueAlgos(self): wscc: str = f"__{self.runNumber}_tmp_group_CC_{self._counts}" for i, (groupID, workspaceIndices) in enumerate(self.groupWorkspaceIndices.items()): + if groupID not in self.maxDSpaceShifts: + # group has been fully masked. + continue workspaceIndices = list(workspaceIndices) refID: int = self.getRefID(workspaceIndices) self.mantidSnapper.CrossCorrelate( - f"Cross-Correlating spectra for {wscc}", + f"Cross-Correlating spectra for {wscc}, subgroup {groupID}", InputWorkspace=self.wsDSP, OutputWorkspace=wscc + f"_group{groupID}", ReferenceSpectra=refID, @@ -230,7 +245,7 @@ def queueAlgos(self): ) self.mantidSnapper.GetDetectorOffsets( - f"Calculate offset workspace {wsoff}", + f"Calculate offset workspace {wsoff}, group {groupID}", InputWorkspace=wscc + f"_group{groupID}", OutputWorkspace=wsoff, MaskWorkspace=self.maskWS, diff --git a/src/snapred/backend/recipe/algorithm/ConjoinDiagnosticWorkspaces.py b/src/snapred/backend/recipe/algorithm/ConjoinDiagnosticWorkspaces.py index b71f37a7c..f681ab269 100644 --- a/src/snapred/backend/recipe/algorithm/ConjoinDiagnosticWorkspaces.py +++ b/src/snapred/backend/recipe/algorithm/ConjoinDiagnosticWorkspaces.py @@ -15,8 +15,11 @@ mtd, ) +from snapred.backend.log.logger import snapredLogger from snapred.meta.mantid.FitPeaksOutput import FIT_PEAK_DIAG_SUFFIX, FitOutputEnum +logger = snapredLogger.getLogger(__name__) + class ConjoinDiagnosticWorkspaces(PythonAlgorithm): """ @@ -127,12 +130,24 @@ def conjoinMatrixWorkspaces(self, inws, outws, index): InputWorkspace=inws, OutputWorkspace=tmpws, ) + logger.debug(f"{outws} already has spectrum numbers of {mtd[outws].getSpectrumNumbers()}") + logger.debug(f"Conjoining {tmpws} with {outws}, adding spectrum numbers of {mtd[tmpws].getSpectrumNumbers()}") + specNumbers = list(mtd[outws].getSpectrumNumbers()) + specNumbers.extend(list(mtd[tmpws].getSpectrumNumbers())) ConjoinWorkspaces( InputWorkspace1=outws, InputWorkspace2=tmpws, CheckOverlapping=False, CheckMatchingBins=False, # Not available in 6.11.0.3rc2 ) + + # TODO: Remove when Defect 14460 is resolved. + # There is a defect in ConjoinWorkspaces that incorrectly determines + # if spectrum numbers need to be remapped. + for i, specNum in enumerate(specNumbers): + mtd[outws].getSpectrum(i).setSpectrumNo(specNum) + + logger.debug(f"resulting spectrum numbers: {mtd[outws].getSpectrumNumbers()}") if self.autoDelete and inws in mtd: DeleteWorkspace(inws) assert outws in mtd diff --git a/src/snapred/backend/recipe/algorithm/FitMultiplePeaksAlgorithm.py b/src/snapred/backend/recipe/algorithm/FitMultiplePeaksAlgorithm.py index 84f08ea29..a5e567ab5 100644 --- a/src/snapred/backend/recipe/algorithm/FitMultiplePeaksAlgorithm.py +++ b/src/snapred/backend/recipe/algorithm/FitMultiplePeaksAlgorithm.py @@ -79,7 +79,20 @@ def PyExec(self): self.chopIngredients(reducedPeakList) self.unbagGroceries() + numHisto = self.mantidSnapper.mtd[self.inputWorkspaceName].getNumberHistograms() + if numHisto < len(self.groupIDs): + raise ValueError( + f"Number of histograms and number of GroupPeakLists do not match: {numHisto} vs {len(self.groupIDs)}" + ) + for index, groupID in enumerate(self.groupIDs): + spectrumInfo = self.mantidSnapper.mtd[self.inputWorkspaceName].spectrumInfo() + numHisto = self.mantidSnapper.mtd[self.inputWorkspaceName].getNumberHistograms() + if spectrumInfo.detectorCount() == 0: + raise ValueError( + f"Spectrum with NO DETECTORS encountered on {self.inputWorkspaceName} at index {index}" + ) + tmpSpecName = mtd.unique_name(prefix=f"__tmp_fitspec_{index}_") outputNameTmp = mtd.unique_name(prefix=f"__tmp_fitdiag_{index}_") outputNamesTmp = {x: f"{outputNameTmp}{self.outputSuffix[x]}_{index}" for x in FitOutputEnum} @@ -120,7 +133,7 @@ def PyExec(self): OutputWorkspace=outputNameTmp, ) self.mantidSnapper.ConjoinDiagnosticWorkspaces( - "Conjoin the diagnostic group workspaces", + f"Conjoin the diagnostic group workspaces for subgroup {groupID}", DiagnosticWorkspace=outputNameTmp, TotalDiagnosticWorkspace=self.outputWorkspaceName, AddAtIndex=index, diff --git a/src/snapred/backend/service/CalibrationService.py b/src/snapred/backend/service/CalibrationService.py index d65aa0689..a6547ba48 100644 --- a/src/snapred/backend/service/CalibrationService.py +++ b/src/snapred/backend/service/CalibrationService.py @@ -129,6 +129,7 @@ def _calibration_N_ref(self, request: DiffractionCalibrationRequest) -> float | def prepDiffractionCalibrationIngredients( self, request: DiffractionCalibrationRequest ) -> DiffractionCalibrationIngredients: + self.validateRequest(request) # fetch the ingredients needed to focus and plot the peaks cifPath = self.dataFactoryService.getCifFilePath(Path(request.calibrantSamplePath).stem) state, _ = self.dataFactoryService.constructStateId(request.runNumber) @@ -147,7 +148,7 @@ def prepDiffractionCalibrationIngredients( maxChiSq=request.maxChiSq, state=state, ) - ingredients = self.sousChef.prepDiffractionCalibrationIngredients(farmFresh) + ingredients = self.sousChef.prepDiffractionCalibrationIngredients(farmFresh, request.combinedPixelMask) ingredients.removeBackground = request.removeBackground return ingredients @@ -155,7 +156,7 @@ def prepDiffractionCalibrationIngredients( @Register("groceries") def fetchDiffractionCalibrationGroceries(self, request: DiffractionCalibrationRequest) -> Dict[str, str]: # groceries - + self.validateRequest(request) # TODO: It would be nice for groceryclerk to be smart enough to flatten versions # However I will save that scope for another time if request.startingTableVersion == VersionState.DEFAULT: @@ -193,23 +194,21 @@ def fetchDiffractionCalibrationGroceries(self, request: DiffractionCalibrationRe maskWorkspace=combinedMask, ) - if self.groceryService.workspaceDoesExist(calibrationMaskName): - self.groceryService.renameWorkspace(calibrationMaskName, combinedMask) - elif request.pixelMasks: - self.groceryService.getCloneOfWorkspace(request.pixelMasks[0], combinedMask) + allMasks = [] + if self.groceryService.workspaceDoesExist(calibrationMaskName): + allMasks.append(calibrationMaskName) if request.pixelMasks: - for mask in request.pixelMasks: - if not self.groceryService.workspaceDoesExist(mask): - raise RuntimeError([f"Pixel mask workspace '{mask}' does not exist"]) - self.mantidSnapper.BinaryOperateMasks( - f"Combine pixel mask workspace {mask} with existing masks", - InputWorkspace1=combinedMask, - InputWorkspace2=mask, - OutputWorkspace=combinedMask, - OperationType="OR", - ) - self.mantidSnapper.executeQueue() + allMasks.extend(request.pixelMasks) + + allMasks.append( + self.groceryService.fetchCompatiblePixelMask(combinedMask, request.runNumber, request.useLiteMode) + ) + + if len(allMasks) > 0: + combinedMask = self.groceryService.combinePixelMasks(combinedMask, allMasks) + else: + combinedMask = "" return groceryDict @@ -222,11 +221,13 @@ def diffractionCalibration(self, request: DiffractionCalibrationRequest) -> Dict # Profiling note: none of the following should be marked as sub-steps: # their service methods are decorated separately. + groceries = self.fetchDiffractionCalibrationGroceries(request) + if not request.combinedPixelMask: + request.combinedPixelMask = groceries.get("maskWorkspace") payload = SimpleDiffCalRequest( ingredients=self.prepDiffractionCalibrationIngredients(request), - groceries=self.fetchDiffractionCalibrationGroceries(request), + groceries=groceries, ) - pixelRes = self.pixelCalibration(payload) if not pixelRes.result: raise RuntimeError("Pixel Calibration failed") @@ -275,9 +276,14 @@ def _calibration_substep_N_ref(self, request: SimpleDiffCalRequest) -> float | N @Register("pixel") def pixelCalibration(self, request: SimpleDiffCalRequest) -> PixelDiffCalServing: # cook recipe + userMaskWs = request.groceries.get("maskWorkspace") + userMaskWs = self.groceryService.getWorkspaceForName(userMaskWs) + numMaskedBeforePixelCal = 0 + if userMaskWs: + numMaskedBeforePixelCal = userMaskWs.getNumberMasked() res = PixelDiffCalRecipe().cook(request.ingredients, request.groceries) maskWS = self.groceryService.getWorkspaceForName(res.maskWorkspace) - percentMasked = maskWS.getNumberMasked() / maskWS.getNumberHistograms() + percentMasked = (maskWS.getNumberMasked() - numMaskedBeforePixelCal) / maskWS.getNumberHistograms() threshold = Config["constants.maskedPixelThreshold"] if percentMasked > threshold: res.result = False @@ -311,6 +317,7 @@ def validateRequest(self, request: DiffractionCalibrationRequest): runNumber=request.runNumber, continueFlags=request.continueFlags ) self.validateWritePermissions(permissionsRequest) + self.sousChef.verifyCalibrationExists(request.runNumber, request.useLiteMode) @Register("validateWritePermissions") def validateWritePermissions(self, request: CalibrationWritePermissionsRequest): @@ -348,7 +355,7 @@ def focusSpectra(self, request: FocusSpectraRequest): farmFresh = FarmFreshIngredients( runNumber=request.runNumber, useLiteMode=request.useLiteMode, focusGroups=[request.focusGroup], state=state ) - pixelGroup = self.sousChef.prepPixelGroup(farmFresh) + pixelGroup = self.sousChef.prepPixelGroup(farmFresh, pixelMask=request.maskWorkspace) # fetch the grouping workspace self.groceryClerk.grouping(request.focusGroup.name).fromRun(request.runNumber).useLiteMode(request.useLiteMode) groupingWorkspace = self.groceryService.fetchGroupingDefinition(self.groceryClerk.build())["workspace"] @@ -681,8 +688,8 @@ def assessQuality(self, request: CalibrationAssessmentRequest): maxChiSq=request.maxChiSq, state=state, ) - pixelGroup = self.sousChef.prepPixelGroup(farmFresh) - detectorPeaks = self.sousChef.prepDetectorPeaks(farmFresh) + pixelGroup = self.sousChef.prepPixelGroup(farmFresh, pixelMask=request.combinedPixelMask) + detectorPeaks = self.sousChef.prepDetectorPeaks(farmFresh, pixelMask=request.combinedPixelMask) # TODO: We Need to Fit the Data fitResults = FitMultiplePeaksRecipe().executeRecipe( diff --git a/src/snapred/backend/service/ReductionService.py b/src/snapred/backend/service/ReductionService.py index 7837ce2c6..63c98c2e2 100644 --- a/src/snapred/backend/service/ReductionService.py +++ b/src/snapred/backend/service/ReductionService.py @@ -429,25 +429,22 @@ def prepCombinedMask(self, request: ReductionRequest) -> WorkspaceName: raise RuntimeError( f"reduction pixel mask '{mask}' has unexpected workspace-type '{mask.tokens('workspaceType')}'" # noqa: E501 ) + # Load all pixel masks - allMasks = self.groceryService.fetchGroceryDict( - self.groceryClerk.buildDict(), - **residentMasks, + allMasks = list( + self.groceryService.fetchGroceryDict( + self.groceryClerk.buildDict(), + **residentMasks, + ).values() ) + # purge empty string, diffcalmask comes back as one if it doesnt exist + allMasks = [m for m in allMasks if m] + allMasks.append(self.groceryService.fetchCompatiblePixelMask(combinedMask, runNumber, useLiteMode)) + if len(allMasks) > 0: + combinedMask = self.groceryService.combinePixelMasks(combinedMask, allMasks) + else: + combinedMask = "" - self.groceryService.fetchCompatiblePixelMask(combinedMask, runNumber, useLiteMode) - for mask in allMasks.values(): - # If there is no mask corresponding to the diffraction calibration, it will be set to the empty string. - if bool(mask): - self.mantidSnapper.BinaryOperateMasks( - f"combine from pixel mask: '{mask}'...", - InputWorkspace1=combinedMask, - InputWorkspace2=mask, - OperationType="OR", - OutputWorkspace=combinedMask, - ) - - self.mantidSnapper.executeQueue() return combinedMask @FromString diff --git a/src/snapred/backend/service/SousChef.py b/src/snapred/backend/service/SousChef.py index 22375f3ee..5dc2a9e49 100644 --- a/src/snapred/backend/service/SousChef.py +++ b/src/snapred/backend/service/SousChef.py @@ -334,14 +334,15 @@ def prepNormalizationIngredients( ) def prepDiffractionCalibrationIngredients( - self, ingredients: FarmFreshIngredients + self, ingredients: FarmFreshIngredients, combinedPixelMask: Optional[WorkspaceName] = None ) -> DiffractionCalibrationIngredients: self.verifyCalibrationExists(ingredients.runNumber, ingredients.useLiteMode) - + pixelGroup = self.prepPixelGroup(ingredients, pixelMask=combinedPixelMask) + groupedPeakLists = self.prepDetectorPeaks(ingredients, pixelMask=combinedPixelMask) return DiffractionCalibrationIngredients( runConfig=self.prepRunConfig(ingredients.runNumber), - pixelGroup=self.prepPixelGroup(ingredients), - groupedPeakLists=self.prepDetectorPeaks(ingredients), + pixelGroup=pixelGroup, + groupedPeakLists=groupedPeakLists, peakFunction=ingredients.peakFunction, convergenceThreshold=ingredients.convergenceThreshold, maxOffset=ingredients.maxOffset, diff --git a/src/snapred/ui/threading/worker_pool.py b/src/snapred/ui/threading/worker_pool.py index e71208b18..4254484a7 100644 --- a/src/snapred/ui/threading/worker_pool.py +++ b/src/snapred/ui/threading/worker_pool.py @@ -51,7 +51,7 @@ def run(self): results = SNAPResponse(code=ResponseCode.RECOVERABLE, message=e.model.json()) except Exception as e: # noqa: BLE001 logger.error(e) - if logger.isEnabledFor(logging.DEBUG): + if logger.isEnabledFor(logging.DEBUG) or True: # print stacktrace import traceback diff --git a/src/snapred/ui/widget/MultiSelectDropDown.py b/src/snapred/ui/widget/MultiSelectDropDown.py index 9a433f8d8..1b5083c9d 100644 --- a/src/snapred/ui/widget/MultiSelectDropDown.py +++ b/src/snapred/ui/widget/MultiSelectDropDown.py @@ -18,6 +18,12 @@ def handleItemPressed(self, index): else: item.setCheckState(Qt.Checked) + def setItemCheckedByValue(self, value): + for index in range(self.count()): + item = self.model().item(index) + if item.text() == value: + item.setCheckState(Qt.Checked) + def checkedItems(self) -> List[str]: checked_items = [] for index in range(self.count()): @@ -72,5 +78,8 @@ def setItems(self, items: List[str] = []): self._items = items self._initItems() + def numItems(self): + return len(self._items) + def checkedItems(self) -> List[str]: return self.dropDown.checkedItems() diff --git a/src/snapred/ui/workflow/DiffCalWorkflow.py b/src/snapred/ui/workflow/DiffCalWorkflow.py index f21e6b846..c0f4bba8b 100644 --- a/src/snapred/ui/workflow/DiffCalWorkflow.py +++ b/src/snapred/ui/workflow/DiffCalWorkflow.py @@ -59,6 +59,9 @@ def __init__(self, parent=None): super().__init__(parent) self.mantidSnapper = MantidSnapper(None, "Utensils") + self.groceries = None + self.ingredients = None + self.combinedPixelMaskName = None # create a tree of flows for the user to successfully execute diffraction calibration # DiffCal Request -> # Check Peaks -> @@ -373,8 +376,11 @@ def _specifyRun(self, workflowPresenter): maxChiSq=self.maxChiSq, pixelMasks=self.pixelMasks, ) - self.ingredients = self.request(path="calibration/ingredients", payload=payload).data self.groceries = self.request(path="calibration/groceries", payload=payload).data + self.combinedPixelMaskName = self.groceries.get("maskWorkspace") + if self.combinedPixelMaskName: + payload.combinedPixelMask = self.combinedPixelMaskName + self.ingredients = self.request(path="calibration/ingredients", payload=payload).data # set "previous" values -- this is their initialization # these are used to compare if the values have changed @@ -390,6 +396,7 @@ def _specifyRun(self, workflowPresenter): # focus the workspace to view the peaks self._renewPixelCal() self.groceries["inputWorkspace"] = self.pixelCalibratedWorkspace + self._renewFocus(self.prevGroupingIndex) self._renewFitPeaks(self.peakFunction) response = self._calculateResidual() @@ -493,6 +500,7 @@ def _createDiffCalRequest( maxChiSq=maxChiSq, removeBackground=self.removeBackground, pixelMasks=pixelMasks, + combinedPixelMask=self.combinedPixelMaskName, ) def _renewIngredients(self, xtalDMin, xtalDMax, peakFunction, fwhm, maxChiSq, pixelMasks): @@ -524,6 +532,7 @@ def _renewFocus(self, groupingIndex): preserveEvents=False, inputWorkspace=self.groceries["inputWorkspace"], groupingWorkspace=self.groceries["groupingWorkspace"], + maskWorkspace=self.groceries.get("maskWorkspace"), ) response = self.request(path="calibration/focus", payload=payload) self.focusedWorkspace = response.data[0] @@ -646,6 +655,7 @@ def _triggerDiffractionCalibration(self, workflowPresenter): nBinsAcrossPeakWidth=self.nBinsAcrossPeakWidth, fwhmMultipliers=self.prevFWHM, maxChiSq=self.maxChiSq, + combinedPixelMask=self.combinedPixelMaskName, ) response = self.request(path="calibration/assessment", payload=payload) diff --git a/tests/integration/test_versions_in_order.py b/tests/integration/test_versions_in_order.py index 7cbb80509..2c711ec89 100644 --- a/tests/integration/test_versions_in_order.py +++ b/tests/integration/test_versions_in_order.py @@ -53,6 +53,7 @@ from snapred.backend.service.SousChef import SousChef from snapred.meta.Config import Resource from snapred.meta.mantid.WorkspaceNameGenerator import ValueFormatter as wnvf +from snapred.meta.mantid.WorkspaceNameGenerator import WorkspaceName from snapred.meta.mantid.WorkspaceNameGenerator import WorkspaceNameGenerator as wng from snapred.meta.mantid.WorkspaceNameGenerator import WorkspaceType as wngt from snapred.meta.redantic import parse_file_as, write_model_pretty @@ -215,6 +216,10 @@ def fetchDefaultDiffCalTable(self, runNumber: str, useLiteMode: bool, version: i CloneWorkspace(InputWorkspace=self.diffcalTableWS, OutputWorkspace=tableWorkspaceName) return tableWorkspaceName + def fetchCompatiblePixelMask(self, maskWSName: WorkspaceName, runNumber: str, useLiteMode: bool) -> WorkspaceName: # noqa: ARG002 + CloneWorkspace(InputWorkspace=self.maskWS, OutputWorkspace=maskWSName) + return maskWSName + class ImitationSousChef(SousChef): """ @@ -223,7 +228,7 @@ class ImitationSousChef(SousChef): generation process. """ - def prepDiffractionCalibrationIngredients(self, ingredients: Any) -> Any: + def prepDiffractionCalibrationIngredients(self, ingredients: Any, combinedPixelMask: WorkspaceName) -> Any: return dataSynthesizer.ingredients diff --git a/tests/integration/test_workflow_panels_happy_path.py b/tests/integration/test_workflow_panels_happy_path.py index aad9488a3..55aeab23e 100644 --- a/tests/integration/test_workflow_panels_happy_path.py +++ b/tests/integration/test_workflow_panels_happy_path.py @@ -1,5 +1,6 @@ import re from contextlib import ExitStack, suppress +from pathlib import Path ## ## In order to retain the normal import order as much as possible: @@ -19,7 +20,7 @@ from util.qt_mock_util import MockQMessageBox from util.TestSummary import TestSummary -from snapred.meta.Config import Resource +from snapred.meta.Config import Config, Resource from snapred.ui.main import SNAPRedGUI, prependDataSearchDirectories from snapred.ui.view.DiffCalAssessmentView import DiffCalAssessmentView from snapred.ui.view.DiffCalRequestView import DiffCalRequestView @@ -45,7 +46,7 @@ def _setup_gui(self, qapp): # DEFAULT PATCHES: # FAIL TEST if any 'warning' OR 'critical' message boxes occur. # In the test body, these patches are overridden for special cases. - + self.workflowState = {} self._warningMessageBox = mock.patch( "qtpy.QtWidgets.QMessageBox.warning", lambda *args, **kwargs: pytest.fail( @@ -525,219 +526,325 @@ def test_calibration_and_reduction_panels_happy_path( # Force a clean exit qtbot.wait(5000) - def test_diffraction_calibration_panel_happy_path(self, qtbot, qapp, calibration_home_from_mirror): # noqa: F811 - # Override the mirror with a new home directory, omitting any existing - # calibration or normalization data. - tmpCalibrationHomeDirectory = calibration_home_from_mirror() # noqa: F841 - self.testSummary = ( - TestSummary.builder() - .step("Open the GUI") - .step("Open the calibration panel") - .step("Set the diffraction calibration request") - .step("Execute the diffraction calibration request") - .step("Tweak the peaks") - .step("Assess the peaks") - .step("Save the diffraction calibration") - .step("Close the GUI") - .build() - ) - with ( - qtbot.captureExceptions() as exceptions, - suppress(InterruptWithBlock), - ): - gui = SNAPRedGUI(translucentBackground=True) - gui.show() - qtbot.addWidget(gui) + def subtest_open_gui(self, qtbot, qapp, calibration_home_from_mirror): # noqa: ARG002 + gui = SNAPRedGUI(translucentBackground=True) + gui.show() + qtbot.addWidget(gui) - """ - SNAPRedGUI owns the following widgets: + """ + SNAPRedGUI owns the following widgets: - * self.calibrationPanelButton [new] = QPushButton("Open Calibration Panel") + * self.calibrationPanelButton [new] = QPushButton("Open Calibration Panel") -