From 4950c88b2c57137a7acd2aef40158782edbc60fa Mon Sep 17 00:00:00 2001
From: "Joachim Wuttke (laptop)" <j.wuttke@fz-juelich.de>
Date: Fri, 29 Mar 2013 10:57:15 +0100
Subject: [PATCH] Enhancing introspection messages. Ex #09b still fails.

---
 BornAgain.pro.user                            | 528 ------------------
 .../src/LayerDecoratorDWBASimulation.cpp      |  43 +-
 Core/Algorithms/src/Simulation.cpp            |   7 +-
 Core/Samples/inc/ICompositeIterator.h         |  18 +-
 Core/Samples/inc/ICompositeSample.h           |  68 ++-
 Core/Samples/inc/ISample.h                    |  12 +-
 Core/Samples/inc/Layer.h                      |   4 +-
 Core/Samples/inc/LayerDecorator.h             |  29 +-
 Core/Samples/inc/MultiLayer.h                 |  56 +-
 Core/Samples/inc/ParticleDecoration.h         |   2 +-
 Core/Samples/src/ICompositeSample.cpp         |   6 +-
 Core/Samples/src/ISample.cpp                  |  18 +-
 Core/Samples/src/Layer.cpp                    |   3 +-
 Core/Samples/src/LayerDecorator.cpp           |   3 +-
 Core/Samples/src/MultiLayer.cpp               |  61 +-
 Core/Samples/src/ParticleDecoration.cpp       |   9 +-
 .../TestCore/IsGISAXS01/IsGISAXS01            | Bin 149826 -> 0 bytes
 .../TestCore/IsGISAXS02/IsGISAXS02            | Bin 154519 -> 0 bytes
 .../TestCore/IsGISAXS03/IsGISAXS03            | Bin 159330 -> 0 bytes
 .../TestCore/IsGISAXS04/IsGISAXS04            | Bin 153940 -> 0 bytes
 .../TestCore/IsGISAXS06/IsGISAXS06            | Bin 175364 -> 0 bytes
 .../TestCore/IsGISAXS07/IsGISAXS07            | Bin 158074 -> 0 bytes
 .../TestCore/IsGISAXS08/IsGISAXS08            | Bin 153860 -> 0 bytes
 .../TestCore/IsGISAXS09/IsGISAXS09            | Bin 161610 -> 0 bytes
 .../TestCore/IsGISAXS09/IsGISAXS09.cpp        |   8 +-
 .../TestCore/IsGISAXS10/IsGISAXS10            | Bin 144137 -> 0 bytes
 .../TestCore/IsGISAXS11/IsGISAXS11            | Bin 150089 -> 0 bytes
 .../TestCore/IsGISAXS15/IsGISAXS15            | Bin 149215 -> 0 bytes
 28 files changed, 202 insertions(+), 673 deletions(-)
 delete mode 100644 BornAgain.pro.user
 delete mode 100755 Tests/FunctionalTests/TestCore/IsGISAXS01/IsGISAXS01
 delete mode 100755 Tests/FunctionalTests/TestCore/IsGISAXS02/IsGISAXS02
 delete mode 100755 Tests/FunctionalTests/TestCore/IsGISAXS03/IsGISAXS03
 delete mode 100755 Tests/FunctionalTests/TestCore/IsGISAXS04/IsGISAXS04
 delete mode 100755 Tests/FunctionalTests/TestCore/IsGISAXS06/IsGISAXS06
 delete mode 100755 Tests/FunctionalTests/TestCore/IsGISAXS07/IsGISAXS07
 delete mode 100755 Tests/FunctionalTests/TestCore/IsGISAXS08/IsGISAXS08
 delete mode 100755 Tests/FunctionalTests/TestCore/IsGISAXS09/IsGISAXS09
 delete mode 100755 Tests/FunctionalTests/TestCore/IsGISAXS10/IsGISAXS10
 delete mode 100755 Tests/FunctionalTests/TestCore/IsGISAXS11/IsGISAXS11
 delete mode 100755 Tests/FunctionalTests/TestCore/IsGISAXS15/IsGISAXS15

diff --git a/BornAgain.pro.user b/BornAgain.pro.user
deleted file mode 100644
index f931a6a6331..00000000000
--- a/BornAgain.pro.user
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-    <value type="QString" key="ProjectExplorer.ProjectConfiguration.Id">Qt4ProjectManager.Qt4BuildConfiguration</value>
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-      <value type="QString" key="ProjectExplorer.ProjectConfiguration.Id">RemoteLinux.DirectUploadStep</value>
-      <valuelist type="QVariantList" key="Qt4ProjectManager.MaemoRunConfiguration.LastDeployedFiles"/>
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-  <value type="int">2</value>
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- <data>
-  <variable>ProjectExplorer.Project.Updater.EnvironmentId</variable>
-  <value type="QString">{145d5f38-77bf-4d59-bdc7-dc52328e50dc}</value>
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diff --git a/Core/Algorithms/src/LayerDecoratorDWBASimulation.cpp b/Core/Algorithms/src/LayerDecoratorDWBASimulation.cpp
index 0a082fe48be..6378ad9d9cd 100644
--- a/Core/Algorithms/src/LayerDecoratorDWBASimulation.cpp
+++ b/Core/Algorithms/src/LayerDecoratorDWBASimulation.cpp
@@ -33,7 +33,7 @@ LayerDecoratorDWBASimulation::~LayerDecoratorDWBASimulation()
 
 void LayerDecoratorDWBASimulation::init(const Simulation& simulation)
 {
-    msglog(MSG::DEBUG) << "LayerDecoratorDWBASimulation::init()\n";
+    msglog(MSG::DEBUG) << "LayerDecoratorDWBASimulation::init()";
     DWBASimulation::init(simulation);
     if (mp_diffuseDWBA) {
         mp_diffuseDWBA->init(simulation);
@@ -42,7 +42,7 @@ void LayerDecoratorDWBASimulation::init(const Simulation& simulation)
 
 void LayerDecoratorDWBASimulation::run()
 {
-    msglog(MSG::DEBUG) << "LayerDecoratorDWBASimulation::run()\n";
+    msglog(MSG::DEBUG) << "LayerDecoratorDWBASimulation::run()";
     IInterferenceFunctionStrategy *p_strategy = createAndInitStrategy();
 
     calculateCoherentIntensity(p_strategy);
@@ -54,20 +54,24 @@ void LayerDecoratorDWBASimulation::run()
 IInterferenceFunctionStrategy
     *LayerDecoratorDWBASimulation::createAndInitStrategy() const
 {
-    LayerDecoratorStrategyBuilder builder(*mp_layer_decorator, *mp_simulation, m_sim_params);
-    if (mp_RT_function) builder.setReflectionTransmissionFunction(*mp_RT_function);
+    LayerDecoratorStrategyBuilder builder(
+        *mp_layer_decorator, *mp_simulation, m_sim_params);
+    if (mp_RT_function)
+        builder.setReflectionTransmissionFunction(*mp_RT_function);
     IInterferenceFunctionStrategy *p_strategy = builder.createStrategy();
     return p_strategy;
 }
 
-std::vector<IFormFactor*> LayerDecoratorDWBASimulation::createDWBAFormFactors() const
+std::vector<IFormFactor*>
+LayerDecoratorDWBASimulation::createDWBAFormFactors() const
 {
-    msglog(MSG::DEBUG) << "LayerDecoratorDWBASimulation::create...\n";
-    std::vector<IFormFactor *> result;
+    msglog(MSG::DEBUG) << "LayerDecoratorDWBASimulation::create...()";
+    std::vector<IFormFactor*> result;
     const IDecoration *p_decoration = mp_layer_decorator->getDecoration();
     complex_t n_layer = mp_layer_decorator->getRefractiveIndex();
     size_t number_of_particles = p_decoration->getNumberOfParticles();
-    for (size_t particle_index=0; particle_index<number_of_particles; ++particle_index) {
+    for (size_t particle_index =
+            0; particle_index<number_of_particles; ++particle_index) {
         Particle *p_particle = p_decoration->getParticleInfo(particle_index)->getParticle()->clone();
         double depth = p_decoration->getParticleInfo(particle_index)->getDepth();
         const Geometry::PTransform3D transform =
@@ -80,28 +84,32 @@ std::vector<IFormFactor*> LayerDecoratorDWBASimulation::createDWBAFormFactors()
         IFormFactor *ff_particle = p_particle->createFormFactor();
         IFormFactor *ff_transformed(0);
         if(transform) {
-            std::cout << "DEBUG: createDWBAff's with transform\n";
+            msglog(MSG::DEBUG) << "LayerDecoratorDWBASimulation::create...() avec!";
             ff_transformed = new FormFactorDecoratorTransformation(
                 ff_particle, transform);
         } else {
-            std::cout << "DEBUG: createDWBAff's without transform\n";
+            msglog(MSG::DEBUG) << "LayerDecoratorDWBASimulation::create...() sans!";
             ff_transformed = ff_particle;
         }
 
         FormFactorDWBAConstZ dwba_z(ff_transformed, depth);
         dwba_z.setReflectionTransmissionFunction(*mp_RT_function);
-        FormFactorDecoratorFactor *p_ff = new FormFactorDecoratorFactor(dwba_z.clone(), wavevector_scattering_factor);
+        FormFactorDecoratorFactor *p_ff =
+            new FormFactorDecoratorFactor(
+                dwba_z.clone(), wavevector_scattering_factor);
         result.push_back(p_ff);
         delete p_particle;
     }
     return result;
 }
 
-void LayerDecoratorDWBASimulation::calculateCoherentIntensity(const IInterferenceFunctionStrategy *p_strategy)
+void LayerDecoratorDWBASimulation::calculateCoherentIntensity(
+    const IInterferenceFunctionStrategy *p_strategy)
 {
-    msglog(MSG::DEBUG) << "Calculating coherent scattering...";
+    msglog(MSG::DEBUG) << "LayerDecoratorDWBASimulation::calculateCoh...()";
     double wavelength = getWaveLength();
-    double total_surface_density = mp_layer_decorator->getTotalParticleSurfaceDensity();
+    double total_surface_density =
+        mp_layer_decorator->getTotalParticleSurfaceDensity();
 
     cvector_t k_ij = m_ki;
     k_ij.setZ(-mp_kz_function->evaluate(-m_alpha_i));
@@ -114,12 +122,15 @@ void LayerDecoratorDWBASimulation::calculateCoherentIntensity(const IInterferenc
         Bin1D alpha_bin = getDWBAIntensity().getBinOfAxis(
             "alpha_f", it_intensity.getIndex());
         double alpha_f = alpha_bin.getMidPoint();
-        if (std::abs(mp_RT_function->evaluate(alpha_f).first)!=0.0 && alpha_f<0) {
+        if (std::abs(mp_RT_function->evaluate(alpha_f).first)!=0.0 &&
+            alpha_f<0) {
             ++it_intensity;
             continue;
         }
         Bin1DCVector k_f_bin = getKfBin(wavelength, alpha_bin, phi_bin);
-        *it_intensity = p_strategy->evaluate(k_ij, k_f_bin, -m_alpha_i, alpha_f)*total_surface_density;
+        *it_intensity =
+            p_strategy->evaluate(k_ij, k_f_bin,
+                                 -m_alpha_i, alpha_f)*total_surface_density;
         ++it_intensity;
     }
 }
diff --git a/Core/Algorithms/src/Simulation.cpp b/Core/Algorithms/src/Simulation.cpp
index 1a51564137f..32f3dbc9003 100644
--- a/Core/Algorithms/src/Simulation.cpp
+++ b/Core/Algorithms/src/Simulation.cpp
@@ -114,6 +114,11 @@ void Simulation::runSimulation()
     int n_threads_total=0;
     if (mp_options)
         n_threads_total = (*mp_options)["threads"].as<int>();
+    msglog(MSG::DEBUG) << "Simulation::runSimulation(): n_threads=" <<
+                          n_threads_total << ", sample: " << *mp_sample;
+    // TODO: --threads=1 is ignored
+    n_threads_total = -1;
+    msglog(MSG::WARNING) << "TEMPORARILY SET n_threads_total = " << n_threads_total;
 
     if(n_threads_total<0) {
         // Single thread.
@@ -137,7 +142,7 @@ void Simulation::runSimulation()
             msglog(MSG::INFO) <<
                 "Simulation::runSimulation() -> Info. Number of threads " <<
                 n_threads_total << " (hardware concurrency: " <<
-                boost::thread::hardware_concurrency() << " )";
+                boost::thread::hardware_concurrency() << ")";
         }
         std::vector<boost::thread*> threads;
         std::vector<DWBASimulation*> simulations;
diff --git a/Core/Samples/inc/ICompositeIterator.h b/Core/Samples/inc/ICompositeIterator.h
index ed6cd50f361..3612c894bf0 100644
--- a/Core/Samples/inc/ICompositeIterator.h
+++ b/Core/Samples/inc/ICompositeIterator.h
@@ -3,8 +3,8 @@
 //  BornAgain: simulate and fit scattering at grazing incidence
 //
 //! @file      Samples/inc/ICompositeIterator.h
-//! @brief     Defines classes MementoState, MementoIterator, 
-//!              ICompositeIterator.
+//! @brief     Defines and implements classes MementoState, MementoIterator; 
+//!              defines class ICompositeIterator.
 //!
 //! @homepage  http://apps.jcns.fz-juelich.de/BornAgain
 //! @license   GNU General Public License v3 or higher (see COPYING)
@@ -28,9 +28,10 @@
 class MementoState
 {
  public:
-   typedef ICompositeSample::iterator_t iterator_t;
+    typedef std::list<ISample*>::iterator iterator_t;
 
-    MementoState(iterator_t itor, iterator_t end_itor) : m_itor( itor ), m_end_itor( end_itor ) { }
+    MementoState(iterator_t itor, iterator_t end_itor)
+        : m_itor( itor ), m_end_itor( end_itor ) { }
 
     MementoState& operator=(const MementoState& other)
     {
@@ -48,17 +49,17 @@ class MementoState
     void next() { m_itor++; }
 
     friend std::ostream& operator<<(std::ostream& o, MementoState const& m)
-    {
-      return  (o << "memento state " <<& m.m_itor << " " <<& m.m_end_itor);
-    }
+    { return  (o << "memento state " <<& m.m_itor << " " <<& m.m_end_itor); }
 
  protected:
     iterator_t m_itor;
     iterator_t m_end_itor;
+
  private:
     MementoState();
 };
 
+
 //! ?
 
 class MementoIterator
@@ -80,7 +81,8 @@ class MementoIterator
     std::stack<MementoState > m_state_stack;
 };
 
-//! Walks through ISample tree of objects inside ICompositeSample object.
+
+//! Iterator through ISample tree of objects inside ICompositeSample object.
 
 //! Usage example:
 //!    ICompositeIterator it = sample->createIterator();
diff --git a/Core/Samples/inc/ICompositeSample.h b/Core/Samples/inc/ICompositeSample.h
index eb1f1b692c4..1213b1e4074 100644
--- a/Core/Samples/inc/ICompositeSample.h
+++ b/Core/Samples/inc/ICompositeSample.h
@@ -3,7 +3,7 @@
 //  BornAgain: simulate and fit scattering at grazing incidence
 //
 //! @file      Samples/inc/ICompositeSample.h
-//! @brief     Defines class ICompositeSample.
+//! @brief     Defines interface class ICompositeSample.
 //!
 //! @homepage  http://apps.jcns.fz-juelich.de/BornAgain
 //! @license   GNU General Public License v3 or higher (see COPYING)
@@ -19,20 +19,30 @@
 #include "ISample.h"
 #include <list>
 
-class ICompositeIterator;
-
 //! Interface to equip ISample with a tree structure.
 
+//! As of March 2013, this is the base class for
+//! - IClustered Particle
+//!   - Crystal
+//! - IDecoration
+//!   - ParticleDecoration
+//! - Layer
+//!   - LayerDecorator
+//! - LayerInterface
+//! - MultiLayer
+//! - Particle
+//!   - LatticeBasis
+//!   - MesoCrystal
+//!   - ParticleCoreShell
+//! - ParticleInfo
+//!   - DiffuseParticleInfo
+//!   - PositionParticleInfo
+//!
 class ICompositeSample : public ISample
 {
  public:
-    //! definition of container for registered children
-    typedef std::list<ISample *> samples_t;
-    typedef samples_t::iterator iterator_t;
-    typedef samples_t::const_iterator const_iterator_t;
-
-    ICompositeSample() { }
-    virtual ~ICompositeSample() { }
+    ICompositeSample() {}
+    virtual ~ICompositeSample() {}
 
     ICompositeSample *clone() const;
 
@@ -40,31 +50,37 @@ class ICompositeSample : public ISample
     virtual ICompositeSample *getCompositeSample() { return this; }
     virtual const ICompositeSample *getCompositeSample() const { return this; }
 
-    //! Registers child in the container
+    //! Registers child in the container.
     virtual void registerChild(ISample *sample);
 
-    //! remove registered child from the container
+    //! Removes registered child from the container
     virtual void deregisterChild(ISample *sample);
 
-    //! iteration over local registered children
-    iterator_t begin_shallow() { return m_samples.begin(); }
-    iterator_t end_shallow() { return m_samples.end(); }
-    const_iterator_t begin_shallow() const { return m_samples.begin(); }
-    const_iterator_t end_shallow() const { return m_samples.end(); }
+    //! Begins iteration over local registered children.
+    std::list<ISample*>::iterator begin_shallow()
+    { return m_samples.begin(); }
 
-    //! size of children
-    virtual size_t size() const { return m_samples.size(); }
+    //! Ends iteration over local registered children.
+    std::list<ISample*>::iterator end_shallow()
+    { return m_samples.end(); }
 
-    //! Creates general iterator to walk through the tree of registered composite children
-    ICompositeIterator createIterator();
+    //! Begins read-only iteration over local registered children.
+    std::list<ISample*>::const_iterator begin_shallow() const
+    { return m_samples.begin(); }
 
- private:
-//    ICompositeSample& operator=(const ICompositeSample& other);
+    //! Ends read-only iteration over local registered children.
+    std::list<ISample*>::const_iterator end_shallow() const
+    { return m_samples.end(); }
+
+    //! Returns number of children.
+    virtual size_t size() const { return m_samples.size(); }
 
-    //! Checks index of child
-    //inline size_t check_index(size_t index) const { return index < m_samples.size() ? index : throw OutOfBoundsException("ICompositeSample::check_index() -> Error! Index is out of bounds"); }
+    //! Creates general iterator to walk through tree of composite children.
+    class ICompositeIterator createIterator();
 
-    samples_t m_samples; //! list of registered children
+ private:
+    //! List of registered children.
+    std::list<ISample*> m_samples;
 };
 
 #endif // ICOMPOSITESAMPLE_H
diff --git a/Core/Samples/inc/ISample.h b/Core/Samples/inc/ISample.h
index 32ee427f921..2ce64de657b 100644
--- a/Core/Samples/inc/ISample.h
+++ b/Core/Samples/inc/ISample.h
@@ -27,7 +27,7 @@ class DWBASimulation;
 class ISample : public IParameterized, public ICloneable
 {
  public:
-    ISample() {}
+    ISample() { setName("ISample"); }
     virtual ~ISample() {}
 
     //! Returns pointer to "this", if it is composite sample (to overload).
@@ -45,15 +45,15 @@ class ISample : public IParameterized, public ICloneable
     //! Walks through composite sample and print content
     virtual void print_structure();
 
-    //! Adds parameters from local pool to external pool and call recursion over direct children
+    //! Adds params from local to external pool, recurses over direct children.
     virtual std::string addParametersToExternalPool(
-            std::string path,
-            ParameterPool *external_pool,
-            int copy_number=-1) const;
+        std::string path,
+        ParameterPool *external_pool,
+        int copy_number=-1) const;
 
  protected:
     virtual void print(std::ostream& ostr) const
-    { ostr << getName() << " " << this << " " << m_parameters; }
+    { ostr << "ISample: " << getName() << " " << this << " " << m_parameters; }
 };
 
 #endif // ISAMPLE_H
diff --git a/Core/Samples/inc/Layer.h b/Core/Samples/inc/Layer.h
index 6f19b0621f2..e149f12675c 100644
--- a/Core/Samples/inc/Layer.h
+++ b/Core/Samples/inc/Layer.h
@@ -58,8 +58,8 @@ class Layer : public ICompositeSample
     //! Returns refractive index of the layer's material.
     virtual complex_t getRefractiveIndex() const
     {
-        return (dynamic_cast<const HomogeneousMaterial *>(mp_material))->
-            getRefractiveIndex();
+        return (dynamic_cast<const HomogeneousMaterial *>
+                (mp_material))->getRefractiveIndex();
     }
 
     //! Returns false (override is important for polymorphism of LayerDecorator).
diff --git a/Core/Samples/inc/LayerDecorator.h b/Core/Samples/inc/LayerDecorator.h
index aebe14f3c44..0b48c00136e 100644
--- a/Core/Samples/inc/LayerDecorator.h
+++ b/Core/Samples/inc/LayerDecorator.h
@@ -20,6 +20,8 @@
 #include "ParticleDecoration.h"
 #include "LayerDecoratorDWBASimulation.h"
 
+//! Equip a layer with thickness, material, refraction index, WHAT ELSE ?
+
 class LayerDecorator : public Layer
 {
  public:
@@ -29,22 +31,24 @@ class LayerDecorator : public Layer
     /// make layer's clone
     virtual LayerDecorator *clone() const;
 
-    //! Sets layer thickness in _angstrom_
-    virtual void setThickness(double thickness) { mp_decorated_layer->setThickness(thickness); }
+    //! Sets layer thickness in Angstrom.
+    virtual void setThickness(double thickness)
+    { mp_decorated_layer->setThickness(thickness); }
 
-    //! Returns layer thickness in _angstrom_
-    virtual double getThickness() const { return mp_decorated_layer->getThickness(); }
+    //! Returns layer thickness in Angstrom.
+    virtual double getThickness() const
+    { return mp_decorated_layer->getThickness(); }
 
     //! @brief set material to the layer
     //! @param p_material   pointer to the material
-    virtual void setMaterial(const IMaterial* p_material) { mp_decorated_layer->setMaterial(p_material); }
+    virtual void setMaterial(const IMaterial* p_material)
+    { mp_decorated_layer->setMaterial(p_material); }
 
     //! @brief set material of given thickness to the layer
     //! @param p_material   pointer to the material of layer
     //! @param thickness    thickness of the material in angstrom
-    virtual void setMaterial(const IMaterial* p_material, double thickness) {
-        mp_decorated_layer->setMaterial(p_material, thickness);
-    }
+    virtual void setMaterial(const IMaterial* p_material, double thickness)
+    { mp_decorated_layer->setMaterial(p_material, thickness); }
 
     //! Returns layer's material
     const virtual IMaterial* getMaterial() const
@@ -54,9 +58,7 @@ class LayerDecorator : public Layer
 
     //! Returns refractive index of the layer's material
     virtual complex_t getRefractiveIndex() const
-    {
-        return mp_decorated_layer->getRefractiveIndex();
-    }
+    { return mp_decorated_layer->getRefractiveIndex(); }
 
     //! Registers some class members for later access via parameter pool
     virtual void init_parameters();
@@ -66,9 +68,8 @@ class LayerDecorator : public Layer
 
     virtual bool hasDWBASimulation() const { return true; }
 
-    virtual LayerDecoratorDWBASimulation *createDWBASimulation() const {
-        return new LayerDecoratorDWBASimulation(this);
-    }
+    virtual LayerDecoratorDWBASimulation *createDWBASimulation() const
+    { return new LayerDecoratorDWBASimulation(this); }
 
     virtual DiffuseDWBASimulation *createDiffuseDWBASimulation() const;
 
diff --git a/Core/Samples/inc/MultiLayer.h b/Core/Samples/inc/MultiLayer.h
index 102fa95d220..40ba5028cd9 100644
--- a/Core/Samples/inc/MultiLayer.h
+++ b/Core/Samples/inc/MultiLayer.h
@@ -51,19 +51,24 @@ class MultiLayer : public ICompositeSample
     void addLayer(const Layer& p_child);
 
     //! Adds layer with top roughness
-    void addLayerWithTopRoughness(const Layer& layer, const LayerRoughness& roughness);
+    void addLayerWithTopRoughness(
+        const Layer& layer, const LayerRoughness& roughness);
 
     //! Returns layer with given index
-    inline const Layer *getLayer(size_t i_layer) const { return m_layers[ check_layer_index(i_layer) ]; }
+    inline const Layer *getLayer(size_t i_layer) const
+    { return m_layers[ check_layer_index(i_layer) ]; }
 
     //! Returns layer with given index
-    inline const LayerInterface *getLayerInterface(size_t i_interface) const { return m_interfaces[ check_interface_index(i_interface) ]; }
+    inline const LayerInterface *getLayerInterface(size_t i_interface) const
+    { return m_interfaces[ check_interface_index(i_interface) ]; }
 
     //! Returns z-coordinate of the layer's bottom
-    inline double getLayerBottomZ(size_t i_layer) const { return m_layers_z[ check_layer_index(i_layer) ]; }
+    inline double getLayerBottomZ(size_t i_layer) const
+    { return m_layers_z[ check_layer_index(i_layer) ]; }
 
     //! Returns thickness of layer
-    inline double getLayerThickness(size_t i_layer) const { return m_layers[ check_layer_index(i_layer) ]->getThickness(); }
+    inline double getLayerThickness(size_t i_layer) const
+    { return m_layers[ check_layer_index(i_layer) ]->getThickness(); }
 
     //! Returns top interface of layer
     const LayerInterface *getLayerTopInterface(size_t i_layer) const;
@@ -78,7 +83,12 @@ class MultiLayer : public ICompositeSample
     virtual MultiLayer *clone() const;
 
     //! Sets cross correlation length of roughnesses between interfaces
-    inline void   setCrossCorrLength(double crossCorrLength) { crossCorrLength!=0 ? m_crossCorrLength = crossCorrLength : throw LogicErrorException("Attempt to set crossCorrLength to zero"); }
+    inline void setCrossCorrLength(double crossCorrLength)
+    {
+        if(!crossCorrLength)
+            throw LogicErrorException("Attempt to set crossCorrLength to zero");
+        m_crossCorrLength = crossCorrLength;
+    }
 
     //! Returns cross correlation length of roughnesses between interfaces
     inline double getCrossCorrLength() const { return m_crossCorrLength; }
@@ -87,13 +97,15 @@ class MultiLayer : public ICompositeSample
     //double getCrossCorrFun(const kvector_t& k, int j, int k) const;
 
     //! Fourier transform of the correlation function of roughnesses between the interfaces
-    double getCrossCorrSpectralFun(const kvector_t& kvec, size_t j, size_t k) const;
+    double getCrossCorrSpectralFun(
+        const kvector_t& kvec, size_t j, size_t k) const;
 
     //! Sets thickness of layer.
     void setLayerThickness(size_t i_layer, double thickness);
 
     //! Prints class
-    friend std::ostream& operator<<(std::ostream& ostr, const MultiLayer& m) { m.print(ostr); return ostr; }
+    friend std::ostream& operator << (std::ostream& ostr, const MultiLayer& m)
+    { m.print(ostr); return ostr; }
 
     //! look for the presence of DWBA terms (e.g. included particles) and return ISimulation if needed
     virtual MultiLayerDWBASimulation *createDWBASimulation() const;
@@ -104,7 +116,6 @@ class MultiLayer : public ICompositeSample
     //! Prints class
     void print(std::ostream& ostr) const;
 
-
  private:
     //! Adds the layer with simultaneous registration in parent class
     void addAndRegisterLayer(Layer *child)
@@ -121,16 +132,29 @@ class MultiLayer : public ICompositeSample
     }
 
     //! Checks index of layer w.r.t. vector length
-    inline size_t check_layer_index(size_t i_layer) const { return i_layer < m_layers.size() ? i_layer : throw OutOfBoundsException("Layer index is out of bounds"); }
+    inline size_t check_layer_index(size_t i_layer) const
+    {
+        if( i_layer >= m_layers.size() )
+            throw OutOfBoundsException("Layer index is out of bounds");
+        return i_layer;
+    }
 
     //! Checks index of interface w.r.t. vector length
-    inline size_t check_interface_index(size_t i_interface) const { return i_interface < m_interfaces.size() ? i_interface : throw OutOfBoundsException("Interface index is out of bounds"); }
-
+    inline size_t check_interface_index(size_t i_interface) const
+    {
+        if( i_interface >= m_interfaces.size() )
+            throw OutOfBoundsException("Interface index is out of bounds"); 
+        return i_interface;
+    }
 
-    std::vector<Layer *> m_layers;                ///< stack of layers [nlayers]
-    std::vector<double > m_layers_z;              ///< coordinate of layer's bottoms [nlayers]
-    std::vector<LayerInterface *> m_interfaces;   ///< stack of layer interfaces [nlayers-1]
-    double m_crossCorrLength;                     //!< cross correlation length (in z direction) between different layers
+    //! stack of layers [nlayers]
+    std::vector<Layer *> m_layers;      
+    //! coordinate of layer's bottoms [nlayers]
+    std::vector<double > m_layers_z;              
+    //! stack of layer interfaces [nlayers-1]
+    std::vector<LayerInterface *> m_interfaces;   
+    //! cross correlation length (in z direction) between different layers
+    double m_crossCorrLength;
 };
 
 #endif // MULTILAYER_H
diff --git a/Core/Samples/inc/ParticleDecoration.h b/Core/Samples/inc/ParticleDecoration.h
index 14d3f463e43..f61b8af9106 100644
--- a/Core/Samples/inc/ParticleDecoration.h
+++ b/Core/Samples/inc/ParticleDecoration.h
@@ -101,7 +101,7 @@ class ParticleDecoration : public IDecoration
     }
 
     //TODO: replace with SafePointerVector
-    std::vector<ParticleInfo *> m_particles;
+    std::vector<ParticleInfo*> m_particles;
 
     //! Vector of the types of particles
     SafePointerVector<IInterferenceFunction> m_interference_functions;
diff --git a/Core/Samples/src/ICompositeSample.cpp b/Core/Samples/src/ICompositeSample.cpp
index a6115a7e006..bf4a558158a 100644
--- a/Core/Samples/src/ICompositeSample.cpp
+++ b/Core/Samples/src/ICompositeSample.cpp
@@ -23,7 +23,8 @@
 
 ICompositeSample *ICompositeSample::clone() const
 {
-    throw NotImplementedException("ICompositeSample::clone() -> Error: not implemented");
+    throw NotImplementedException("ICompositeSample::clone() -> "
+                                  "Error: not implemented");
 }
 
 
@@ -34,7 +35,8 @@ void ICompositeSample::registerChild(ISample *sample)
     if(sample) {
         m_samples.push_back(sample);
     } else {
-        msglog(MSG::ERROR) << "ICompositeSample::registerChild() -> Attempt to register NULL child in this " << *this;
+        msglog(MSG::ERROR) << "ICompositeSample::registerChild() -> "
+            "Attempt to register NULL child in this " << *this;
     }
 }
 
diff --git a/Core/Samples/src/ISample.cpp b/Core/Samples/src/ISample.cpp
index 9ce9ae3c273..835e4d97f15 100644
--- a/Core/Samples/src/ISample.cpp
+++ b/Core/Samples/src/ISample.cpp
@@ -46,7 +46,7 @@ void ISample::print_structure()
     }
 }
 
-//! Adds parameters from local pool to external pool and call recursion over direct children
+//! Adds params from local to external pool and recurses over direct children.
 
 std::string ISample::addParametersToExternalPool(
     std::string path, ParameterPool *external_pool, int copy_number) const
@@ -54,22 +54,22 @@ std::string ISample::addParametersToExternalPool(
     std::string new_path =
         IParameterized::addParametersToExternalPool(
             path, external_pool, copy_number);
-
-    // going through direct children of given sample and copy they parameters recursively
+    // go through direct children of given sample and
+    // copy their parameters recursively
     const ICompositeSample *sample = getCompositeSample();
     if( sample ) {
-
-        // Here we need some default mechanism to handle cases with many children with same name.
+        // Here we need some default mechanism to handle cases with
+        // many children with same name.
         // Lets run through all direct children and save their names
         Utils::StringUsageMap strUsageMap;
-        for(ICompositeSample::const_iterator_t it =
+        for(std::list<ISample*>::const_iterator it =
                 sample->begin_shallow(); it!=sample->end_shallow(); ++it) {
             strUsageMap.add( new_path +(*it)->getName() ); // saving children name
         }
-
-        // Now we run through direct children again, and assign copy number for all children with same name
+        // Now we run through direct children again,
+        // and assign copy number for all children with same name
         Utils::StringUsageMap strUsageMap2;
-        for(ICompositeSample::const_iterator_t it=
+        for(std::list<ISample*>::const_iterator it=
                 sample->begin_shallow(); it!=sample->end_shallow(); ++it) {
             std::string children_name = new_path +(*it)->getName();
             strUsageMap2.add(children_name);
diff --git a/Core/Samples/src/Layer.cpp b/Core/Samples/src/Layer.cpp
index b264f17fb10..ac515956dc7 100644
--- a/Core/Samples/src/Layer.cpp
+++ b/Core/Samples/src/Layer.cpp
@@ -26,7 +26,8 @@ Layer::Layer() : mp_material(0), m_thickness(0)
     init_parameters();
 }
 
-Layer::Layer(const IMaterial* p_material, double thickness) : mp_material(0), m_thickness(0)
+Layer::Layer(const IMaterial* p_material, double thickness)
+    : mp_material(0), m_thickness(0)
 {
     setName("Layer");
     setMaterial(p_material);
diff --git a/Core/Samples/src/LayerDecorator.cpp b/Core/Samples/src/LayerDecorator.cpp
index 603bc08188d..81a2ee9e69d 100644
--- a/Core/Samples/src/LayerDecorator.cpp
+++ b/Core/Samples/src/LayerDecorator.cpp
@@ -17,8 +17,7 @@
 
 LayerDecorator::LayerDecorator(const Layer& layer,
         const IDecoration& decoration)
-: mp_decorated_layer(layer.clone())
-, mp_decoration(decoration.clone())
+    : mp_decorated_layer(layer.clone()), mp_decoration(decoration.clone())
 {
     setName("LayerDecorator");
     registerChild(mp_decorated_layer);
diff --git a/Core/Samples/src/MultiLayer.cpp b/Core/Samples/src/MultiLayer.cpp
index 0bde64de144..be939024cbf 100644
--- a/Core/Samples/src/MultiLayer.cpp
+++ b/Core/Samples/src/MultiLayer.cpp
@@ -93,34 +93,34 @@ MultiLayer *MultiLayer::clone() const
     return newMultiLayer;
 }
 
-/* ************************************************************************* */
-// return pointer to the top interface of the layer
-// (nInterfaces = nLayers-1, first layer in multilayer doesn't have interface)
-/* ************************************************************************* */
+//! Returns pointer to the top interface of the layer.
+
+//! nInterfaces = nLayers-1, first layer in multilayer doesn't have interface.
+//!
 const LayerInterface *MultiLayer::getLayerTopInterface(size_t i_layer) const
 {
     return i_layer>0 ? m_interfaces[ check_interface_index(i_layer-1) ] : 0;
 }
 
-
-/* ************************************************************************* */
-// return pointer to the bottom interface of the layer
-// (nInterfaces = nLayers-1, i.e. last layer in multilayer doesn't have interface)
-/* ************************************************************************* */
+//! Returns pointer to the bottom interface of the layer.
 const LayerInterface *MultiLayer::getLayerBottomInterface(size_t i_layer) const
 {
-    return i_layer<m_interfaces.size() ? m_interfaces[ check_interface_index(i_layer) ] : 0;
+    return i_layer<m_interfaces.size() ?
+        m_interfaces[ check_interface_index(i_layer) ] : 0;
 }
 
 //! Adds layer with top roughness
 
-void MultiLayer::addLayerWithTopRoughness(const Layer& layer, const LayerRoughness& roughness)
+void MultiLayer::addLayerWithTopRoughness(
+    const Layer& layer, const LayerRoughness& roughness)
 {
     Layer *p_new_layer = layer.clone();
     if (getNumberOfLayers())
     {
         const Layer *p_last_layer = m_layers.back();
-        LayerInterface *interface = LayerInterface::createRoughInterface( p_last_layer, p_new_layer, roughness);
+        LayerInterface *interface =
+            LayerInterface::createRoughInterface(
+                p_last_layer, p_new_layer, roughness);
         addAndRegisterLayer(p_new_layer);
         addAndRegisterInterface(interface);
         m_layers_z.push_back(m_layers_z.back() - layer.getThickness() );
@@ -153,11 +153,13 @@ double MultiLayer::getCrossCorrSpectralFun(const kvector_t& kvec, size_t j, size
     double sigma_j = rough_j->getSigma();
     double sigma_k = rough_k->getSigma();
     if(sigma_j == 0 || sigma_k == 0) return 0.0;
-    double corr = 0.5*( (sigma_k/sigma_j)*rough_j->getSpectralFun(kvec) + (sigma_j/sigma_k)*rough_k->getSpectralFun(kvec) ) * std::exp( -1*std::abs(z_j-z_k)/m_crossCorrLength );
+    double corr = 0.5*( (sigma_k/sigma_j)*rough_j->getSpectralFun(kvec) +
+                        (sigma_j/sigma_k)*rough_k->getSpectralFun(kvec) ) *
+        std::exp( -1*std::abs(z_j-z_k)/m_crossCorrLength );
     return corr;
 }
 
-//! change layer thickness
+//! Changes layer thickness.
 
 void MultiLayer::setLayerThickness(size_t i_layer, double thickness)
 {
@@ -166,43 +168,40 @@ void MultiLayer::setLayerThickness(size_t i_layer, double thickness)
     m_layers_z.clear();
     m_layers_z.push_back(0.0);
     for(size_t il=1; il<getNumberOfLayers(); il++){
-        m_layers_z.push_back(m_layers_z.back() - m_layers[ check_layer_index(il) ]->getThickness() );
+        m_layers_z.push_back(
+            m_layers_z.back() -
+            m_layers[ check_layer_index(il) ]->getThickness() );
     }
 }
 
-//! change layer thickness
+//! ?
 
 MultiLayerDWBASimulation* MultiLayer::createDWBASimulation() const
 {
     for (size_t i=0; i<getNumberOfLayers(); ++i) {
-        if( getLayer(i)->hasDWBASimulation() ) return new MultiLayerDWBASimulation(this);
-//        LayerDWBASimulation *p_layer_dwba_sim = getLayer(i)->createDWBASimulation();
-//        if ( p_layer_dwba_sim ) {
-//            delete p_layer_dwba_sim;
-//            return new MultiLayerDWBASimulation(this);
-//        }
+        if( getLayer(i)->hasDWBASimulation() )
+            return new MultiLayerDWBASimulation(this);
     }
 
     for(size_t i=0; i<getNumberOfInterfaces(); ++i) {
-        if( getLayerInterface(i)->getRoughness() ) return new MultiLayerDWBASimulation(this);
+        if( getLayerInterface(i)->getRoughness() )
+            return new MultiLayerDWBASimulation(this);
     }
     return 0;
 }
 
 void MultiLayer::print(std::ostream& ostr) const
 {
-    ostr << getName() << " " << this << std::endl;
-
+    ostr << "{\n" << getName() << " " << this << std::endl;
     for(size_t i=0; i<getNumberOfLayers(); i++) {
-        const Layer *layer = getLayer(i);
-        ostr << " " << "#" << std::left << std::setw(2) << i
-             << *layer
-             << std::endl;
+        ostr << " layer " << std::left << std::setw(2) << i << ": "
+             << *getLayer(i) << std::endl;
         const LayerInterface *interface = getLayerBottomInterface(i);
         if(interface) {
-            ostr << " " << "------" << *interface << std::endl;
+            ostr << " int.face: " << *interface << std::endl;
         } else {
-            ostr << " " << "------ no interface " << std::endl;
+            ostr << " int.face: none" << std::endl;
         }
     }
+    ostr << "}";
 }
diff --git a/Core/Samples/src/ParticleDecoration.cpp b/Core/Samples/src/ParticleDecoration.cpp
index f71c43db4d0..2957c2b5481 100644
--- a/Core/Samples/src/ParticleDecoration.cpp
+++ b/Core/Samples/src/ParticleDecoration.cpp
@@ -54,14 +54,12 @@ ParticleDecoration* ParticleDecoration::clone() const
     ParticleDecoration *p_new = new ParticleDecoration();
     p_new->setName(getName());
 
-    for (size_t i=0; i<m_particles.size(); ++i) {
+    for (size_t i=0; i<m_particles.size(); ++i)
         p_new->addAndRegisterParticleInfo(m_particles[i]->clone());
-    }
 
-    for (size_t i=0; i<m_interference_functions.size(); ++i) {
+    for (size_t i=0; i<m_interference_functions.size(); ++i)
         p_new->addAndRegisterInterferenceFunction(
             m_interference_functions[i]->clone());
-    }
 
     p_new->m_total_abundance = m_total_abundance;
     p_new->setTotalParticleSurfaceDensity(getTotalParticleSurfaceDensity());
@@ -118,9 +116,8 @@ void ParticleDecoration::addParticleInfo(const ParticleInfo& info)
 
 const ParticleInfo* ParticleDecoration::getParticleInfo(size_t index) const
 {
-    if (index<m_particles.size()) {
+    if (index<m_particles.size())
         return m_particles[index];
-    }
     throw OutOfBoundsException(
         "ParticleDecoration::getParticleInfo() -> "
         "Error! Not so many interference functions in this decoration.");
diff --git a/Tests/FunctionalTests/TestCore/IsGISAXS01/IsGISAXS01 b/Tests/FunctionalTests/TestCore/IsGISAXS01/IsGISAXS01
deleted file mode 100755
index f36f25a8a0f03d02a19d6babfd776fa437b2ab23..0000000000000000000000000000000000000000
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diff --git a/Tests/FunctionalTests/TestCore/IsGISAXS09/IsGISAXS09.cpp b/Tests/FunctionalTests/TestCore/IsGISAXS09/IsGISAXS09.cpp
index c7a5109bdc8..745e736f626 100644
--- a/Tests/FunctionalTests/TestCore/IsGISAXS09/IsGISAXS09.cpp
+++ b/Tests/FunctionalTests/TestCore/IsGISAXS09/IsGISAXS09.cpp
@@ -35,7 +35,7 @@ FunctionalTests::IsGISAXS09::~IsGISAXS09()
 }
 
 
-// IsGISAXS example #9: pyramid
+// IsGISAXS example #9a: pyramid
 void FunctionalTests::IsGISAXS09::runpyramidZ0()
 {
     // building sample
@@ -56,8 +56,8 @@ void FunctionalTests::IsGISAXS09::runpyramidZ0()
                                            5*Units::nanometer,
                                            Units::deg2rad(54.73 ) ) ) );
     particle_decoration.addInterferenceFunction(new InterferenceFunctionNone());
-    LayerDecorator air_layer_decorator(air_layer, particle_decoration);
 
+    LayerDecorator air_layer_decorator(air_layer, particle_decoration);
     multi_layer.addLayer(air_layer_decorator);
     multi_layer.addLayer(substrate_layer);
 
@@ -76,7 +76,7 @@ void FunctionalTests::IsGISAXS09::runpyramidZ0()
 }
 
 
-// IsGISAXS example #9: rotated pyramid
+// IsGISAXS example #9b: rotated pyramid
 void FunctionalTests::IsGISAXS09::runpyramidZ45()
 {
     // building sample
@@ -101,9 +101,9 @@ void FunctionalTests::IsGISAXS09::runpyramidZ45()
         new Geometry::RotateZ_3D(45.*Units::degree) );
 
     ParticleDecoration particle_decoration;
-
     particle_decoration.addParticle(pyramid, transform);
     particle_decoration.addInterferenceFunction(new InterferenceFunctionNone());
+
     LayerDecorator air_layer_decorator(air_layer, particle_decoration);
     multi_layer.addLayer(air_layer_decorator);
     multi_layer.addLayer(substrate_layer);
diff --git a/Tests/FunctionalTests/TestCore/IsGISAXS10/IsGISAXS10 b/Tests/FunctionalTests/TestCore/IsGISAXS10/IsGISAXS10
deleted file mode 100755
index b615da1c7162a6d5022f5f76231340f46cfd70db..0000000000000000000000000000000000000000
GIT binary patch
literal 0
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diff --git a/Tests/FunctionalTests/TestCore/IsGISAXS11/IsGISAXS11 b/Tests/FunctionalTests/TestCore/IsGISAXS11/IsGISAXS11
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