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Example 36 with Expression

use of cbit.vcell.parser.Expression in project vcell by virtualcell.

the class XmlReader method getElectricalStimulus.

/**
 * This method process Electrical Stimulus, also called Clamps.
 * Creation date: (6/6/2002 4:46:18 PM)
 * @return cbit.vcell.mapping.ElectricalStimulus
 * @param param org.jdom.Element
 */
private ElectricalStimulus getElectricalStimulus(Element param, SimulationContext currentSimulationContext) throws XmlParseException {
    ElectricalStimulus clampStimulus = null;
    // get name
    // String name = unMangle( param.getAttributeValue(XMLTags.NameAttrTag) );
    // get Electrode
    Electrode electrode = getElectrode(param.getChild(XMLTags.ElectrodeTag, vcNamespace), currentSimulationContext);
    if (param.getAttributeValue(XMLTags.TypeAttrTag).equalsIgnoreCase(XMLTags.VoltageClampTag)) {
        // is a voltage clamp
        clampStimulus = new VoltageClampStimulus(electrode, "voltClampElectrode", new Expression(0.0), currentSimulationContext);
    } else if (param.getAttributeValue(XMLTags.TypeAttrTag).equalsIgnoreCase(XMLTags.CurrentDensityClampTag) || param.getAttributeValue(XMLTags.TypeAttrTag).equalsIgnoreCase(XMLTags.CurrentDensityClampTag_oldName)) {
        // is a current density clamp
        clampStimulus = new CurrentDensityClampStimulus(electrode, "currDensityClampElectrode", new Expression(0.0), currentSimulationContext);
    } else if (param.getAttributeValue(XMLTags.TypeAttrTag).equalsIgnoreCase(XMLTags.TotalCurrentClampTag)) {
        // is a "total" current clamp
        clampStimulus = new TotalCurrentClampStimulus(electrode, "totalCurrClampElectrode", new Expression(0.0), currentSimulationContext);
    }
    try {
        // transaction begin flag ... yeah, this is a hack
        clampStimulus.reading(true);
        // Read all of the parameters
        List<Element> list = param.getChildren(XMLTags.ParameterTag, vcNamespace);
        // add constants that may be used in the electrical stimulus.
        VariableHash varHash = new VariableHash();
        Model model = currentSimulationContext.getModel();
        addResevedSymbols(varHash, model);
        // 
        for (Element xmlParam : list) {
            String paramName = unMangle(xmlParam.getAttributeValue(XMLTags.NameAttrTag));
            String role = xmlParam.getAttributeValue(XMLTags.ParamRoleAttrTag);
            String paramExpStr = xmlParam.getText();
            Expression paramExp = unMangleExpression(paramExpStr);
            try {
                if (varHash.getVariable(paramName) == null) {
                    Domain domain = null;
                    varHash.addVariable(new Function(paramName, paramExp, domain));
                } else {
                    if (model.getReservedSymbolByName(paramName) != null) {
                        varHash.removeVariable(paramName);
                        Domain domain = null;
                        varHash.addVariable(new Function(paramName, paramExp, domain));
                    }
                }
            } catch (MathException e) {
                e.printStackTrace(System.out);
                throw new XmlParseException("error reordering parameters according to dependencies:", e);
            }
            LocalParameter tempParam = null;
            if (!role.equals(XMLTags.ParamRoleUserDefinedTag)) {
                if (role.equals(XMLTags.ParamRoleTotalCurrentTag)) {
                    if (clampStimulus instanceof TotalCurrentClampStimulus) {
                        tempParam = ((TotalCurrentClampStimulus) clampStimulus).getCurrentParameter();
                    } else {
                        varHash.removeVariable(paramName);
                        continue;
                    }
                } else if (role.equals(XMLTags.ParamRoleTotalCurrentDensityTag) || role.equals(XMLTags.ParamRoleTotalCurrentDensityOldNameTag)) {
                    if (clampStimulus instanceof CurrentDensityClampStimulus) {
                        tempParam = ((CurrentDensityClampStimulus) clampStimulus).getCurrentDensityParameter();
                    } else {
                        varHash.removeVariable(paramName);
                        continue;
                    }
                } else if (role.equals(XMLTags.ParamRolePotentialDifferenceTag)) {
                    if (clampStimulus instanceof VoltageClampStimulus) {
                        tempParam = ((VoltageClampStimulus) clampStimulus).getVoltageParameter();
                    } else {
                        varHash.removeVariable(paramName);
                        continue;
                    }
                }
            } else {
                continue;
            }
            if (tempParam == null) {
                throw new XmlParseException("parameter with role '" + role + "' not found in electricalstimulus");
            }
            // 
            if (!tempParam.getName().equals(paramName)) {
                LocalParameter multNameParam = clampStimulus.getLocalParameter(paramName);
                int n = 0;
                while (multNameParam != null) {
                    String tempName = paramName + "_" + n++;
                    clampStimulus.renameParameter(paramName, tempName);
                    multNameParam = clampStimulus.getLocalParameter(tempName);
                }
                clampStimulus.renameParameter(tempParam.getName(), paramName);
            }
        }
        // 
        // create unresolved parameters for all unresolved symbols
        // 
        String unresolvedSymbol = varHash.getFirstUnresolvedSymbol();
        while (unresolvedSymbol != null) {
            try {
                Domain domain = null;
                // will turn into an UnresolvedParameter.
                varHash.addVariable(new Function(unresolvedSymbol, new Expression(0.0), domain));
            } catch (MathException e) {
                e.printStackTrace(System.out);
                throw new XmlParseException(e.getMessage());
            }
            clampStimulus.addUnresolvedParameter(unresolvedSymbol);
            unresolvedSymbol = varHash.getFirstUnresolvedSymbol();
        }
        Variable[] sortedVariables = varHash.getTopologicallyReorderedVariables();
        ModelUnitSystem modelUnitSystem = model.getUnitSystem();
        for (int i = sortedVariables.length - 1; i >= 0; i--) {
            if (sortedVariables[i] instanceof Function) {
                Function paramFunction = (Function) sortedVariables[i];
                Element xmlParam = null;
                for (int j = 0; j < list.size(); j++) {
                    Element tempParam = (Element) list.get(j);
                    if (paramFunction.getName().equals(unMangle(tempParam.getAttributeValue(XMLTags.NameAttrTag)))) {
                        xmlParam = tempParam;
                        break;
                    }
                }
                if (xmlParam == null) {
                    // must have been an unresolved parameter
                    continue;
                }
                String symbol = xmlParam.getAttributeValue(XMLTags.VCUnitDefinitionAttrTag);
                VCUnitDefinition unit = null;
                if (symbol != null) {
                    unit = modelUnitSystem.getInstance(symbol);
                }
                LocalParameter tempParam = clampStimulus.getLocalParameter(paramFunction.getName());
                if (tempParam == null) {
                    clampStimulus.addUserDefinedParameter(paramFunction.getName(), paramFunction.getExpression(), unit);
                } else {
                    if (tempParam.getExpression() != null) {
                        // if the expression is null, it should remain null.
                        clampStimulus.setParameterValue(tempParam, paramFunction.getExpression());
                    }
                    tempParam.setUnitDefinition(unit);
                }
            }
        }
    } catch (java.beans.PropertyVetoException e) {
        e.printStackTrace(System.out);
        throw new XmlParseException("Exception while setting parameters for simContext : " + currentSimulationContext.getName(), e);
    } catch (ExpressionException e) {
        e.printStackTrace(System.out);
        throw new XmlParseException("Exception while settings parameters for simContext : " + currentSimulationContext.getName(), e);
    } finally {
        clampStimulus.reading(false);
    }
    return clampStimulus;
}
Also used : Electrode(cbit.vcell.mapping.Electrode) FilamentVariable(cbit.vcell.math.FilamentVariable) OutsideVariable(cbit.vcell.math.OutsideVariable) StochVolVariable(cbit.vcell.math.StochVolVariable) RandomVariable(cbit.vcell.math.RandomVariable) VolumeRandomVariable(cbit.vcell.math.VolumeRandomVariable) VolumeParticleVariable(cbit.vcell.math.VolumeParticleVariable) VolumeRegionVariable(cbit.vcell.math.VolumeRegionVariable) InsideVariable(cbit.vcell.math.InsideVariable) VolVariable(cbit.vcell.math.VolVariable) MembraneRegionVariable(cbit.vcell.math.MembraneRegionVariable) PointVariable(cbit.vcell.math.PointVariable) MembraneRandomVariable(cbit.vcell.math.MembraneRandomVariable) MembraneParticleVariable(cbit.vcell.math.MembraneParticleVariable) ParticleVariable(cbit.vcell.math.ParticleVariable) MemVariable(cbit.vcell.math.MemVariable) FilamentRegionVariable(cbit.vcell.math.FilamentRegionVariable) Variable(cbit.vcell.math.Variable) VariableHash(cbit.vcell.math.VariableHash) Element(org.jdom.Element) CurrentDensityClampStimulus(cbit.vcell.mapping.CurrentDensityClampStimulus) TotalCurrentClampStimulus(cbit.vcell.mapping.TotalCurrentClampStimulus) ExpressionException(cbit.vcell.parser.ExpressionException) LocalParameter(cbit.vcell.mapping.ParameterContext.LocalParameter) PropertyVetoException(java.beans.PropertyVetoException) ElectricalStimulus(cbit.vcell.mapping.ElectricalStimulus) AnnotatedFunction(cbit.vcell.solver.AnnotatedFunction) Function(cbit.vcell.math.Function) VCUnitDefinition(cbit.vcell.units.VCUnitDefinition) Expression(cbit.vcell.parser.Expression) VoltageClampStimulus(cbit.vcell.mapping.VoltageClampStimulus) MathException(cbit.vcell.math.MathException) MathModel(cbit.vcell.mathmodel.MathModel) Model(cbit.vcell.model.Model) PathwayModel(org.vcell.pathway.PathwayModel) RelationshipModel(org.vcell.relationship.RelationshipModel) BioModel(cbit.vcell.biomodel.BioModel) MembraneSubDomain(cbit.vcell.math.MembraneSubDomain) CompartmentSubDomain(cbit.vcell.math.CompartmentSubDomain) FilamentSubDomain(cbit.vcell.math.FilamentSubDomain) PointSubDomain(cbit.vcell.math.PointSubDomain) Domain(cbit.vcell.math.Variable.Domain) ModelUnitSystem(cbit.vcell.model.ModelUnitSystem)

Example 37 with Expression

use of cbit.vcell.parser.Expression in project vcell by virtualcell.

the class XmlReader method getConvolutionDataGenerator.

private ConvolutionDataGenerator getConvolutionDataGenerator(Element element) {
    String name = unMangle(element.getAttributeValue(XMLTags.NameAttrTag));
    Expression volumeFunction = null;
    Element volumeFunctionElement = element.getChild(XMLTags.FunctionTag, vcNamespace);
    if (volumeFunctionElement == null) {
        volumeFunctionElement = element.getChild(XMLTags.VolumeFunctionTag, vcNamespace);
    }
    if (volumeFunctionElement != null) {
        String s = volumeFunctionElement.getText();
        volumeFunction = unMangleExpression(s);
    }
    Expression membraneFunction = null;
    Element membraneFunctionElement = element.getChild(XMLTags.MembraneFunctionTag, vcNamespace);
    if (membraneFunctionElement != null) {
        String s = membraneFunctionElement.getText();
        membraneFunction = unMangleExpression(s);
    }
    ConvolutionDataGeneratorKernel kernel = null;
    Element kernelElement = element.getChild(XMLTags.Kernel, vcNamespace);
    String kernelType = kernelElement.getAttributeValue(XMLTags.TypeAttrTag);
    if (kernelType.equals(XMLTags.KernelType_Gaussian)) {
        Element e0 = kernelElement.getChild(XMLTags.KernelGaussianSigmaXY, vcNamespace);
        String s = e0.getText();
        Expression sigmaXY = unMangleExpression(s);
        e0 = kernelElement.getChild(XMLTags.KernelGaussianSigmaZ, vcNamespace);
        s = e0.getText();
        Expression sigmaZ = unMangleExpression(s);
        kernel = new GaussianConvolutionDataGeneratorKernel(sigmaXY, sigmaZ);
    }
    ConvolutionDataGenerator cdg = new ConvolutionDataGenerator(name, kernel, volumeFunction, membraneFunction);
    return cdg;
}
Also used : Expression(cbit.vcell.parser.Expression) Element(org.jdom.Element) ConvolutionDataGenerator(cbit.vcell.math.ConvolutionDataGenerator) GaussianConvolutionDataGeneratorKernel(cbit.vcell.math.ConvolutionDataGenerator.GaussianConvolutionDataGeneratorKernel) GaussianConvolutionDataGeneratorKernel(cbit.vcell.math.ConvolutionDataGenerator.GaussianConvolutionDataGeneratorKernel) ConvolutionDataGeneratorKernel(cbit.vcell.math.ConvolutionDataGenerator.ConvolutionDataGeneratorKernel)

Example 38 with Expression

use of cbit.vcell.parser.Expression in project vcell by virtualcell.

the class XmlReader method getAnalyticSubVolume.

/**
 * This method returns an AnalyticSubVolume object from a XML representation.
 * Creation date: (5/1/2001 5:26:17 PM)
 * @return cbit.vcell.geometry.AnalyticSubVolume
 * @param param org.jdom.Element
 */
private AnalyticSubVolume getAnalyticSubVolume(Element param) throws XmlParseException {
    // retrieve the attributes
    String name = param.getAttributeValue(XMLTags.NameAttrTag);
    int handle = Integer.parseInt(param.getAttributeValue(XMLTags.HandleAttrTag));
    // process the key
    KeyValue key = null;
    String temp = param.getAttributeValue(XMLTags.KeyValueAttrTag);
    if (temp != null && temp.length() > 0 && this.readKeysFlag) {
        key = new KeyValue(temp);
    }
    // Retrieve the expression
    temp = param.getChildText(XMLTags.AnalyticExpressionTag, vcNamespace);
    if (temp == null) {
        throw new XmlParseException("A Problem occured while retrieving the analytic expression of the AnalyticSubvolume " + name);
    }
    Expression newexpression = unMangleExpression(temp);
    // Create the AnalyticCompartment
    AnalyticSubVolume newsubvolume = null;
    try {
        newsubvolume = new AnalyticSubVolume(key, name, newexpression, handle);
    } catch (ExpressionException e) {
        e.printStackTrace();
        throw new XmlParseException("An ExpressionException occured when creating the new AnalyticSubvolume " + name, e);
    }
    return newsubvolume;
}
Also used : KeyValue(org.vcell.util.document.KeyValue) Expression(cbit.vcell.parser.Expression) AnalyticSubVolume(cbit.vcell.geometry.AnalyticSubVolume) ExpressionException(cbit.vcell.parser.ExpressionException)

Example 39 with Expression

use of cbit.vcell.parser.Expression in project vcell by virtualcell.

the class Xmlproducer method getXML.

/**
 * This method returns a XML representation of a SpeciesContextSpec object.
 * Creation date: (3/1/2001 9:13:56 PM)
 * @return Element
 * @param param cbit.vcell.mapping.SpeciesContextSpec
 */
private Element getXML(SpeciesContextSpec param) {
    Element speciesContextSpecElement = new Element(XMLTags.SpeciesContextSpecTag);
    // Add Attributes
    speciesContextSpecElement.setAttribute(XMLTags.SpeciesContextRefAttrTag, mangle(param.getSpeciesContext().getName()));
    speciesContextSpecElement.setAttribute(XMLTags.ForceConstantAttrTag, String.valueOf(param.isConstant()));
    // speciesContextSpecElement.setAttribute(XMLTags.EnableDiffusionAttrTag, String.valueOf(param.isEnableDiffusing()));
    if (param.isWellMixed() != null) {
        speciesContextSpecElement.setAttribute(XMLTags.WellMixedAttrTag, String.valueOf(param.isWellMixed()));
    }
    if (param.isForceContinuous() != null) {
        speciesContextSpecElement.setAttribute(XMLTags.ForceContinuousAttrTag, String.valueOf(param.isForceContinuous()));
    }
    // Add initial
    Expression initCon = param.getInitialConcentrationParameter().getExpression();
    Expression initAmt = param.getInitialCountParameter().getExpression();
    if (initCon != null) {
        Element initial = new Element(XMLTags.InitialConcentrationTag);
        initial.addContent(mangleExpression(initCon));
        speciesContextSpecElement.addContent(initial);
    } else if (initAmt != null) {
        Element initial = new Element(XMLTags.InitialAmountTag);
        initial.addContent(mangleExpression(initAmt));
        speciesContextSpecElement.addContent(initial);
    }
    // Add diffusion
    cbit.vcell.parser.Expression diffRate = param.getDiffusionParameter().getExpression();
    if (diffRate != null) {
        Element diffusion = new Element(XMLTags.DiffusionTag);
        diffusion.addContent(mangleExpression(diffRate));
        speciesContextSpecElement.addContent(diffusion);
    }
    // write BoundaryConditions
    cbit.vcell.parser.Expression exp;
    Element boundaries = new Element(XMLTags.BoundariesTag);
    // XM
    exp = param.getBoundaryXmParameter().getExpression();
    if (exp != null) {
        boundaries.setAttribute(XMLTags.BoundaryAttrValueXm, mangleExpression(exp));
    }
    // XP
    exp = param.getBoundaryXpParameter().getExpression();
    if (exp != null) {
        boundaries.setAttribute(XMLTags.BoundaryAttrValueXp, mangleExpression(exp));
    }
    // YM
    exp = param.getBoundaryYmParameter().getExpression();
    if (exp != null) {
        boundaries.setAttribute(XMLTags.BoundaryAttrValueYm, mangleExpression(exp));
    }
    // YP
    exp = param.getBoundaryYpParameter().getExpression();
    if (exp != null) {
        boundaries.setAttribute(XMLTags.BoundaryAttrValueYp, mangleExpression(exp));
    }
    // ZM
    exp = param.getBoundaryZmParameter().getExpression();
    if (exp != null) {
        boundaries.setAttribute(XMLTags.BoundaryAttrValueZm, mangleExpression(exp));
    }
    // ZP
    exp = param.getBoundaryZpParameter().getExpression();
    if (exp != null) {
        boundaries.setAttribute(XMLTags.BoundaryAttrValueZp, mangleExpression(exp));
    }
    if (boundaries.getAttributes().size() > 0) {
        speciesContextSpecElement.addContent(boundaries);
    }
    // Add Velocities Vx, Vy, Vz
    Element velocityElement = null;
    Expression velX = param.getVelocityXParameter().getExpression();
    if (velX != null) {
        velocityElement = new Element(XMLTags.VelocityTag);
        velocityElement.setAttribute(XMLTags.XAttrTag, mangleExpression(velX));
    }
    Expression velY = param.getVelocityYParameter().getExpression();
    if (velY != null) {
        if (velocityElement == null) {
            velocityElement = new Element(XMLTags.VelocityTag);
        }
        velocityElement.setAttribute(XMLTags.YAttrTag, mangleExpression(velY));
    }
    Expression velZ = param.getVelocityZParameter().getExpression();
    if (velZ != null) {
        if (velocityElement == null) {
            velocityElement = new Element(XMLTags.VelocityTag);
        }
        velocityElement.setAttribute(XMLTags.ZAttrTag, mangleExpression(velZ));
    }
    if (velocityElement != null) {
        speciesContextSpecElement.addContent(velocityElement);
    }
    return speciesContextSpecElement;
}
Also used : Expression(cbit.vcell.parser.Expression) Element(org.jdom.Element) Expression(cbit.vcell.parser.Expression)

Example 40 with Expression

use of cbit.vcell.parser.Expression in project vcell by virtualcell.

the class MathModel_SBMLExporter method addGeometry.

private static void addGeometry(Model sbmlModel, MathModel vcMathModel) {
    SpatialModelPlugin mplugin = (SpatialModelPlugin) sbmlModel.getPlugin(SBMLUtils.SBML_SPATIAL_NS_PREFIX);
    // Creates a geometry object via SpatialModelPlugin object.
    org.sbml.jsbml.ext.spatial.Geometry sbmlGeometry = mplugin.getGeometry();
    sbmlGeometry.setCoordinateSystem(GeometryKind.cartesian);
    Geometry vcGeometry = vcMathModel.getGeometry();
    // 
    // list of CoordinateComponents : 1 if geometry is 1-d, 2 if geometry is 2-d, 3 if geometry is 3-d
    // 
    int dimension = vcGeometry.getDimension();
    Extent vcExtent = vcGeometry.getExtent();
    Origin vcOrigin = vcGeometry.getOrigin();
    // add x coordinate component
    CoordinateComponent coordCompX = sbmlGeometry.createCoordinateComponent();
    coordCompX.setSpatialId("CoordCompX");
    coordCompX.setType(CoordinateKind.cartesianX);
    Boundary minX = coordCompX.getBoundaryMaximum();
    minX.setSpatialId("Xmin");
    minX.setValue(vcOrigin.getX());
    Boundary maxX = coordCompX.getBoundaryMaximum();
    maxX.setSpatialId("Xmax");
    maxX.setValue(vcOrigin.getX() + (vcExtent.getX()));
    Parameter parameterX = sbmlModel.createParameter();
    // note for exporting BioModels rather than MathModels, get ReservedSymbol from Model with Role of ReservedSymbolRole.X
    parameterX.setId(ReservedVariable.X.getName());
    SpatialSymbolReference coordXSpatialRef = new SpatialSymbolReference();
    coordXSpatialRef.setSpatialRef(coordCompX.getSpatialId());
    SpatialParameterPlugin parameterXSpatialPlugin = (SpatialParameterPlugin) parameterX.getPlugin(SBMLUtils.SBML_SPATIAL_NS_PREFIX);
    parameterXSpatialPlugin.setParamType(coordXSpatialRef);
    // add y coordinate component
    if (dimension == 2 || dimension == 3) {
        CoordinateComponent coordCompY = sbmlGeometry.createCoordinateComponent();
        coordCompY.setSpatialId("CoordCompY");
        coordCompY.setType(CoordinateKind.cartesianY);
        Boundary minY = coordCompY.getBoundaryMinimum();
        minY.setId("Ymin");
        minY.setValue(vcOrigin.getY());
        Boundary maxY = coordCompY.getBoundaryMaximum();
        maxY.setId("Ymax");
        maxY.setValue(vcOrigin.getY() + (vcExtent.getY()));
        Parameter parameterY = sbmlModel.createParameter();
        // note for exporting BioModels rather than MathModels, get ReservedSymbol from Model with Role of ReservedSymbolRole.Y
        parameterY.setId(ReservedVariable.Y.getName());
        SpatialSymbolReference coordYSpatialRef = new SpatialSymbolReference();
        coordYSpatialRef.setSpatialRef(coordCompY.getSpatialId());
        SpatialParameterPlugin parameterYSpatialPlugin = (SpatialParameterPlugin) parameterY.getPlugin(SBMLUtils.SBML_SPATIAL_NS_PREFIX);
        parameterYSpatialPlugin.setParamType(coordYSpatialRef);
    }
    // add z coordinate component
    if (dimension == 3) {
        CoordinateComponent coordCompZ = sbmlGeometry.createCoordinateComponent();
        coordCompZ.setSpatialId("CoordCompZ");
        coordCompZ.setType(CoordinateKind.cartesianZ);
        Boundary minZ = coordCompZ.getBoundaryMinimum();
        minZ.setId("Zmin");
        minZ.setValue(vcOrigin.getZ());
        Boundary maxZ = coordCompZ.getBoundaryMaximum();
        maxZ.setId("Zmax");
        maxZ.setValue(vcOrigin.getZ() + (vcExtent.getZ()));
        Parameter parameterZ = sbmlModel.createParameter();
        // note for exporting BioModels rather than MathModels, get ReservedSymbol from Model with Role of ReservedSymbolRole.Y
        parameterZ.setId(ReservedVariable.Z.getName());
        SpatialSymbolReference coordZSpatialRef = new SpatialSymbolReference();
        coordZSpatialRef.setSpatialRef(coordCompZ.getSpatialId());
        SpatialParameterPlugin parameterZSpatialPlugin = (SpatialParameterPlugin) parameterZ.getPlugin(SBMLUtils.SBML_SPATIAL_NS_PREFIX);
        parameterZSpatialPlugin.setParamType(coordZSpatialRef);
    }
    // 
    // list of domain types : subvolumes and surface classes from VC
    // Also create compartments - one compartment for each geometryClass. set id and spatialDimension based on type of geometryClass.
    // 
    boolean bAnalyticGeom = false;
    boolean bImageGeom = false;
    GeometryClass[] vcGeomClasses = vcGeometry.getGeometryClasses();
    int numVCGeomClasses = vcGeomClasses.length;
    for (int i = 0; i < numVCGeomClasses; i++) {
        DomainType domainType = sbmlGeometry.createDomainType();
        domainType.setId(vcGeomClasses[i].getName());
        if (vcGeomClasses[i] instanceof SubVolume) {
            if (((SubVolume) vcGeomClasses[i]) instanceof AnalyticSubVolume) {
                bAnalyticGeom = true;
            } else if (((SubVolume) vcGeomClasses[i]) instanceof ImageSubVolume) {
                bImageGeom = true;
            }
            domainType.setSpatialDimensions(3);
        } else if (vcGeomClasses[i] instanceof SurfaceClass) {
            domainType.setSpatialDimensions(2);
        }
    }
    // 
    // list of domains, adjacent domains : from VC geometricRegions
    // 
    GeometrySurfaceDescription vcGSD = vcGeometry.getGeometrySurfaceDescription();
    if (vcGSD.getRegionImage() == null) {
        try {
            vcGSD.updateAll();
        } catch (Exception e) {
            e.printStackTrace(System.out);
            throw new RuntimeException("Unable to generate region images for geometry");
        }
    }
    GeometricRegion[] vcGeometricRegions = vcGSD.getGeometricRegions();
    ISize sampleSize = vcGSD.getVolumeSampleSize();
    int numX = sampleSize.getX();
    int numY = sampleSize.getY();
    int numZ = sampleSize.getZ();
    double ox = vcOrigin.getX();
    double oy = vcOrigin.getY();
    double oz = vcOrigin.getZ();
    RegionInfo[] regionInfos = vcGSD.getRegionImage().getRegionInfos();
    Compartment compartment = null;
    for (int i = 0; i < vcGeometricRegions.length; i++) {
        // domains
        Domain domain = sbmlGeometry.createDomain();
        domain.setId(vcGeometricRegions[i].getName());
        compartment = sbmlModel.createCompartment();
        compartment.setId("compartment" + i);
        if (vcGeometricRegions[i] instanceof VolumeGeometricRegion) {
            domain.setDomainType(((VolumeGeometricRegion) vcGeometricRegions[i]).getSubVolume().getName());
            // domain.setImplicit(false);
            compartment.setSpatialDimensions(3);
            InteriorPoint interiorPt = domain.createInteriorPoint();
            int regionID = ((VolumeGeometricRegion) vcGeometricRegions[i]).getRegionID();
            boolean bFound = false;
            int regInfoIndx = 0;
            for (int j = 0; j < regionInfos.length; j++) {
                regInfoIndx = j;
                if (regionInfos[j].getRegionIndex() == regionID) {
                    int volIndx = 0;
                    for (int z = 0; z < numZ && !bFound; z++) {
                        for (int y = 0; y < numY && !bFound; y++) {
                            for (int x = 0; x < numX && !bFound; x++) {
                                if (regionInfos[j].isIndexInRegion(volIndx)) {
                                    bFound = true;
                                    double unit_z = (numZ > 1) ? ((double) z) / (numZ - 1) : 0.5;
                                    double coordZ = oz + vcExtent.getZ() * unit_z;
                                    double unit_y = (numY > 1) ? ((double) y) / (numY - 1) : 0.5;
                                    double coordY = oy + vcExtent.getY() * unit_y;
                                    double unit_x = (numX > 1) ? ((double) x) / (numX - 1) : 0.5;
                                    double coordX = ox + vcExtent.getX() * unit_x;
                                    interiorPt.setCoord1(coordX);
                                    interiorPt.setCoord2(coordY);
                                    interiorPt.setCoord3(coordZ);
                                }
                                volIndx++;
                            }
                        // end - for x
                        }
                    // end - for y
                    }
                // end - for z
                }
            // end if
            }
            // end for regionInfos
            if (!bFound) {
                throw new RuntimeException("Unable to find interior point for region '" + regionInfos[regInfoIndx].toString());
            }
        } else if (vcGeometricRegions[i] instanceof SurfaceGeometricRegion) {
            SurfaceGeometricRegion vcSurfaceGeomReg = (SurfaceGeometricRegion) vcGeometricRegions[i];
            GeometricRegion geomRegion0 = vcSurfaceGeomReg.getAdjacentGeometricRegions()[0];
            GeometricRegion geomRegion1 = vcSurfaceGeomReg.getAdjacentGeometricRegions()[1];
            SurfaceClass surfaceClass = vcGSD.getSurfaceClass(((VolumeGeometricRegion) geomRegion0).getSubVolume(), ((VolumeGeometricRegion) geomRegion1).getSubVolume());
            domain.setDomainType(surfaceClass.getName());
            // domain.setImplicit(true);
            compartment.setSpatialDimensions(2);
            // adjacent domains : 2 adjacent domain objects for each surfaceClass in VC.
            // adjacent domain 1
            AdjacentDomains adjDomain = sbmlGeometry.createAdjacentDomain();
            adjDomain.setId(TokenMangler.mangleToSName(vcSurfaceGeomReg.getName() + "_" + geomRegion0.getName()));
            adjDomain.setDomain1(vcSurfaceGeomReg.getName());
            adjDomain.setDomain2(geomRegion0.getName());
            // adjacent domain 2
            adjDomain = sbmlGeometry.createAdjacentDomain();
            adjDomain.setId(TokenMangler.mangleToSName(vcSurfaceGeomReg.getName() + "_" + geomRegion1.getName()));
            adjDomain.setDomain1(vcSurfaceGeomReg.getName());
            adjDomain.setDomain2(geomRegion1.getName());
        }
        // 
        // Mathmodel does not have structureMapping, hence creating compartmentMapping while creating domains.
        // @TODO : how to assign unitSize for compartmentMapping?
        // 
        SpatialCompartmentPlugin cplugin = (SpatialCompartmentPlugin) compartment.getPlugin(SBMLUtils.SBML_SPATIAL_NS_PREFIX);
        CompartmentMapping compMapping = cplugin.getCompartmentMapping();
        String compMappingId = TokenMangler.mangleToSName(domain.getDomainType() + "_" + compartment.getId());
        compMapping.setId(compMappingId);
        compMapping.setDomainType(TokenMangler.mangleToSName(domain.getDomainType()));
    // try {
    // compMapping.setUnitSize(1.0);
    // } catch (ExpressionException e) {
    // e.printStackTrace(System.out);
    // throw new RuntimeException("Unable to create compartment mapping for structureMapping '" + compMapping.getId() +"' : " + e.getMessage());
    // }
    }
    AnalyticGeometry sbmlAnalyticGeom = null;
    SampledFieldGeometry sbmlSFGeom = null;
    // both image and analytic subvolumes?? == not handled in SBML at this time.
    if (bAnalyticGeom && !bImageGeom) {
        sbmlAnalyticGeom = sbmlGeometry.createAnalyticGeometry();
        sbmlAnalyticGeom.setId(TokenMangler.mangleToSName(vcGeometry.getName()));
    } else if (bImageGeom && !bAnalyticGeom) {
        // assuming image based geometry if not analytic geometry
        sbmlSFGeom = sbmlGeometry.createSampledFieldGeometry();
        sbmlSFGeom.setId(TokenMangler.mangleToSName(vcGeometry.getName()));
    } else if (bAnalyticGeom && bImageGeom) {
        throw new RuntimeException("Export to SBML of a combination of Image-based and Analytic geometries is not supported yet.");
    } else if (!bAnalyticGeom && !bImageGeom) {
        throw new RuntimeException("Unknown geometry type.");
    }
    // 
    for (int i = 0; i < vcGeomClasses.length; i++) {
        if (vcGeomClasses[i] instanceof AnalyticSubVolume) {
            // add analytiVols to sbmlAnalyticGeometry
            if (sbmlAnalyticGeom != null) {
                AnalyticVolume analyticVol = sbmlAnalyticGeom.createAnalyticVolume();
                analyticVol.setId(vcGeomClasses[i].getName());
                analyticVol.setDomainType(vcGeomClasses[i].getName());
                analyticVol.setFunctionType(FunctionKind.layered);
                analyticVol.setOrdinal(i);
                Expression expr = ((AnalyticSubVolume) vcGeomClasses[i]).getExpression();
                try {
                    String mathMLStr = ExpressionMathMLPrinter.getMathML(expr, true);
                    ASTNode mathMLNode = ASTNode.readMathMLFromString(mathMLStr);
                    analyticVol.setMath(mathMLNode);
                } catch (Exception e) {
                    e.printStackTrace(System.out);
                    throw new RuntimeException("Error converting VC subvolume expression to mathML" + e.getMessage());
                }
            } else {
                throw new RuntimeException("SBML AnalyticGeometry is null.");
            }
        } else if (vcGeomClasses[i] instanceof ImageSubVolume) {
            // add sampledVols to sbmlSFGeometry
            if (sbmlSFGeom != null) {
                SampledVolume sampledVol = sbmlSFGeom.createSampledVolume();
                sampledVol.setId(vcGeomClasses[i].getName());
                sampledVol.setDomainType(vcGeomClasses[i].getName());
                sampledVol.setSampledValue(((ImageSubVolume) vcGeomClasses[i]).getPixelValue());
            } else {
                throw new RuntimeException("SBML SampledFieldGeometry is null.");
            }
        }
    }
    if (sbmlSFGeom != null) {
        // add sampledField to sampledFieldGeometry
        SampledField sampledField = sbmlGeometry.createSampledField();
        VCImage vcImage = vcGeometry.getGeometrySpec().getImage();
        sampledField.setId(vcImage.getName());
        sampledField.setNumSamples1(vcImage.getNumX());
        if (vcImage.getNumY() > 1) {
            sampledField.setNumSamples2(vcImage.getNumY());
        }
        if (vcImage.getNumZ() > 1) {
            sampledField.setNumSamples3(vcImage.getNumZ());
        }
        sampledField.setInterpolationType(InterpolationKind.nearestneighbor);
        sampledField.setDataType(DataKind.UINT8);
        // add image from vcGeometrySpec to sampledField.
        try {
            StringBuffer sb = new StringBuffer();
            byte[] imagePixelsBytes = vcImage.getPixelsCompressed();
            for (int i = 0; i < imagePixelsBytes.length; i++) {
                int uint8_sample = ((int) imagePixelsBytes[i]) & 0xff;
                sb.append(uint8_sample + " ");
            }
            sampledField.setSamplesLength(vcImage.getNumXYZ());
            sampledField.setSamples(sb.toString().trim());
        } catch (ImageException e) {
            e.printStackTrace(System.out);
            throw new RuntimeException("Unable to export image from VCell to SBML : " + e.getMessage());
        }
    }
}
Also used : Origin(org.vcell.util.Origin) CompartmentMapping(org.sbml.jsbml.ext.spatial.CompartmentMapping) Compartment(org.sbml.jsbml.Compartment) SpatialParameterPlugin(org.sbml.jsbml.ext.spatial.SpatialParameterPlugin) AnalyticGeometry(org.sbml.jsbml.ext.spatial.AnalyticGeometry) Boundary(org.sbml.jsbml.ext.spatial.Boundary) DomainType(org.sbml.jsbml.ext.spatial.DomainType) SampledVolume(org.sbml.jsbml.ext.spatial.SampledVolume) SubVolume(cbit.vcell.geometry.SubVolume) ImageSubVolume(cbit.vcell.geometry.ImageSubVolume) AnalyticSubVolume(cbit.vcell.geometry.AnalyticSubVolume) SpatialCompartmentPlugin(org.sbml.jsbml.ext.spatial.SpatialCompartmentPlugin) CoordinateComponent(org.sbml.jsbml.ext.spatial.CoordinateComponent) VolumeGeometricRegion(cbit.vcell.geometry.surface.VolumeGeometricRegion) VolumeGeometricRegion(cbit.vcell.geometry.surface.VolumeGeometricRegion) SurfaceGeometricRegion(cbit.vcell.geometry.surface.SurfaceGeometricRegion) GeometricRegion(cbit.vcell.geometry.surface.GeometricRegion) SpatialSymbolReference(org.sbml.jsbml.ext.spatial.SpatialSymbolReference) AnalyticVolume(org.sbml.jsbml.ext.spatial.AnalyticVolume) InteriorPoint(org.sbml.jsbml.ext.spatial.InteriorPoint) SampledField(org.sbml.jsbml.ext.spatial.SampledField) Domain(org.sbml.jsbml.ext.spatial.Domain) AnalyticSubVolume(cbit.vcell.geometry.AnalyticSubVolume) GeometryClass(cbit.vcell.geometry.GeometryClass) ImageException(cbit.image.ImageException) GeometrySurfaceDescription(cbit.vcell.geometry.surface.GeometrySurfaceDescription) Extent(org.vcell.util.Extent) SurfaceClass(cbit.vcell.geometry.SurfaceClass) ISize(org.vcell.util.ISize) RegionInfo(cbit.vcell.geometry.RegionImage.RegionInfo) VCImage(cbit.image.VCImage) ASTNode(org.sbml.jsbml.ASTNode) ImageSubVolume(cbit.vcell.geometry.ImageSubVolume) SurfaceGeometricRegion(cbit.vcell.geometry.surface.SurfaceGeometricRegion) SampledFieldGeometry(org.sbml.jsbml.ext.spatial.SampledFieldGeometry) SpatialModelPlugin(org.sbml.jsbml.ext.spatial.SpatialModelPlugin) InteriorPoint(org.sbml.jsbml.ext.spatial.InteriorPoint) XMLStreamException(javax.xml.stream.XMLStreamException) ImageException(cbit.image.ImageException) SBMLException(org.sbml.jsbml.SBMLException) AdjacentDomains(org.sbml.jsbml.ext.spatial.AdjacentDomains) Geometry(cbit.vcell.geometry.Geometry) AnalyticGeometry(org.sbml.jsbml.ext.spatial.AnalyticGeometry) SampledFieldGeometry(org.sbml.jsbml.ext.spatial.SampledFieldGeometry) Expression(cbit.vcell.parser.Expression) Parameter(org.sbml.jsbml.Parameter)

Aggregations

Expression (cbit.vcell.parser.Expression)549 ExpressionException (cbit.vcell.parser.ExpressionException)163 VCUnitDefinition (cbit.vcell.units.VCUnitDefinition)76 PropertyVetoException (java.beans.PropertyVetoException)73 Variable (cbit.vcell.math.Variable)69 ArrayList (java.util.ArrayList)58 Vector (java.util.Vector)56 MathException (cbit.vcell.math.MathException)55 VolVariable (cbit.vcell.math.VolVariable)53 SymbolTableEntry (cbit.vcell.parser.SymbolTableEntry)51 SpeciesContext (cbit.vcell.model.SpeciesContext)50 Element (org.jdom.Element)47 KineticsParameter (cbit.vcell.model.Kinetics.KineticsParameter)45 ExpressionBindingException (cbit.vcell.parser.ExpressionBindingException)45 Model (cbit.vcell.model.Model)43 Function (cbit.vcell.math.Function)42 Constant (cbit.vcell.math.Constant)41 ModelParameter (cbit.vcell.model.Model.ModelParameter)41 ModelUnitSystem (cbit.vcell.model.ModelUnitSystem)41 LocalParameter (cbit.vcell.mapping.ParameterContext.LocalParameter)38