Changeset 042f82 for src/parser.hpp

Timestamp:

Jul 23, 2009, 2:21:57 PM (16 years ago)

Author:

Frederik Heber <heber@…>

Branches:

Action_Thermostats, Add_AtomRandomPerturbation, Add_FitFragmentPartialChargesAction, Add_RotateAroundBondAction, Add_SelectAtomByNameAction, Added_ParseSaveFragmentResults, AddingActions_SaveParseParticleParameters, Adding_Graph_to_ChangeBondActions, Adding_MD_integration_tests, Adding_ParticleName_to_Atom, Adding_StructOpt_integration_tests, AtomFragments, Automaking_mpqc_open, AutomationFragmentation_failures, Candidate_v1.5.4, Candidate_v1.6.0, Candidate_v1.6.1, ChangeBugEmailaddress, ChangingTestPorts, ChemicalSpaceEvaluator, CombiningParticlePotentialParsing, Combining_Subpackages, Debian_Package_split, Debian_package_split_molecuildergui_only, Disabling_MemDebug, Docu_Python_wait, EmpiricalPotential_contain_HomologyGraph, EmpiricalPotential_contain_HomologyGraph_documentation, Enable_parallel_make_install, Enhance_userguide, Enhanced_StructuralOptimization, Enhanced_StructuralOptimization_continued, Example_ManyWaysToTranslateAtom, Exclude_Hydrogens_annealWithBondGraph, FitPartialCharges_GlobalError, Fix_BoundInBox_CenterInBox_MoleculeActions, Fix_ChargeSampling_PBC, Fix_ChronosMutex, Fix_FitPartialCharges, Fix_FitPotential_needs_atomicnumbers, Fix_ForceAnnealing, Fix_IndependentFragmentGrids, Fix_ParseParticles, Fix_ParseParticles_split_forward_backward_Actions, Fix_PopActions, Fix_QtFragmentList_sorted_selection, Fix_Restrictedkeyset_FragmentMolecule, Fix_StatusMsg, Fix_StepWorldTime_single_argument, Fix_Verbose_Codepatterns, Fix_fitting_potentials, Fixes, ForceAnnealing_goodresults, ForceAnnealing_oldresults, ForceAnnealing_tocheck, ForceAnnealing_with_BondGraph, ForceAnnealing_with_BondGraph_continued, ForceAnnealing_with_BondGraph_continued_betteresults, ForceAnnealing_with_BondGraph_contraction-expansion, FragmentAction_writes_AtomFragments, FragmentMolecule_checks_bonddegrees, GeometryObjects, Gui_Fixes, Gui_displays_atomic_force_velocity, ImplicitCharges, IndependentFragmentGrids, IndependentFragmentGrids_IndividualZeroInstances, IndependentFragmentGrids_IntegrationTest, IndependentFragmentGrids_Sole_NN_Calculation, JobMarket_RobustOnKillsSegFaults, JobMarket_StableWorkerPool, JobMarket_unresolvable_hostname_fix, MoreRobust_FragmentAutomation, ODR_violation_mpqc_open, PartialCharges_OrthogonalSummation, PdbParser_setsAtomName, PythonUI_with_named_parameters, QtGui_reactivate_TimeChanged_changes, Recreated_GuiChecks, Rewrite_FitPartialCharges, RotateToPrincipalAxisSystem_UndoRedo, SaturateAtoms_findBestMatching, SaturateAtoms_singleDegree, StoppableMakroAction, Subpackage_CodePatterns, Subpackage_JobMarket, Subpackage_LinearAlgebra, Subpackage_levmar, Subpackage_mpqc_open, Subpackage_vmg, Switchable_LogView, ThirdParty_MPQC_rebuilt_buildsystem, TrajectoryDependenant_MaxOrder, TremoloParser_IncreasedPrecision, TremoloParser_MultipleTimesteps, TremoloParser_setsAtomName, Ubuntu_1604_changes, stable

Children:

36ec71

Parents:

205ccd

Message:

fixed indentation from tabs to two spaces.

File:

• src/parser.hpp (modified) (4 diffs)

src/parser.hpp

@@ -40 +40 @@
 
 class MatrixContainer {
-        public:
-                double ***Matrix;
-                int **Indices;
-                char *Header;
-                int MatrixCounter;
-                int *RowCounter;
-                int ColumnCounter;
+  public:
+    double ***Matrix;
+    int **Indices;
+    char *Header;
+    int MatrixCounter;
+    int *RowCounter;
+    int ColumnCounter;
 
-        MatrixContainer();
-        virtual ~MatrixContainer();
+  MatrixContainer();
+  virtual ~MatrixContainer();
 
-        bool ParseMatrix(const char *name, int skiplines, int skipcolumns, int MatrixNr);
-        virtual bool ParseFragmentMatrix(const char *name, const char *prefix, string suffix, int skiplines, int skipcolumns);
-        bool AllocateMatrix(const char *GivenHeader, int MCounter, int *RCounter, int CCounter);
-        bool ResetMatrix();
-        double FindMinValue();
-        double FindMaxValue();
-        bool SetLastMatrix(double value, int skipcolumns);
-        bool SetLastMatrix(double **values, int skipcolumns);
-        //bool ParseIndices();
-        //bool SumSubValues();
-        bool SumSubManyBodyTerms(class MatrixContainer &Matrix, class KeySetsContainer &KeySet, int Order);
-        bool WriteTotalFragments(const char *name, const char *prefix);
-        bool WriteLastMatrix(const char *name, const char *prefix, const char *suffix);
+  bool ParseMatrix(const char *name, int skiplines, int skipcolumns, int MatrixNr);
+  virtual bool ParseFragmentMatrix(const char *name, const char *prefix, string suffix, int skiplines, int skipcolumns);
+  bool AllocateMatrix(const char *GivenHeader, int MCounter, int *RCounter, int CCounter);
+  bool ResetMatrix();
+  double FindMinValue();
+  double FindMaxValue();
+  bool SetLastMatrix(double value, int skipcolumns);
+  bool SetLastMatrix(double **values, int skipcolumns);
+  //bool ParseIndices();
+  //bool SumSubValues();
+  bool SumSubManyBodyTerms(class MatrixContainer &Matrix, class KeySetsContainer &KeySet, int Order);
+  bool WriteTotalFragments(const char *name, const char *prefix);
+  bool WriteLastMatrix(const char *name, const char *prefix, const char *suffix);
 };
 
@@ -69 +69 @@
 
 class EnergyMatrix : public MatrixContainer {
-        public:
-                bool ParseIndices();
-                bool SumSubEnergy(class EnergyMatrix &Fragments, class EnergyMatrix *CorrectionFragments, class KeySetsContainer &KeySet, int Order, double sign);
-                bool ParseFragmentMatrix(const char *name, const char *prefix, string suffix, int skiplines, int skipcolumns);
+  public:
+    bool ParseIndices();
+    bool SumSubEnergy(class EnergyMatrix &Fragments, class EnergyMatrix *CorrectionFragments, class KeySetsContainer &KeySet, int Order, double sign);
+    bool ParseFragmentMatrix(const char *name, const char *prefix, string suffix, int skiplines, int skipcolumns);
 };
 
@@ -78 +78 @@
 
 class ForceMatrix : public MatrixContainer {
-        public:
-                bool ParseIndices(const char *name);
-                bool SumSubForces(class ForceMatrix &Fragments, class KeySetsContainer &KeySet, int Order, double sign);
-                bool ParseFragmentMatrix(const char *name, const char *prefix, string suffix, int skiplines, int skipcolumns);
+  public:
+    bool ParseIndices(const char *name);
+    bool SumSubForces(class ForceMatrix &Fragments, class KeySetsContainer &KeySet, int Order, double sign);
+    bool ParseFragmentMatrix(const char *name, const char *prefix, string suffix, int skiplines, int skipcolumns);
 };
 
@@ -87 +87 @@
 
 class KeySetsContainer {
-        public:
-                int **KeySets;
-                int *AtomCounter;
-                int FragmentCounter;
-                int Order;
-                int *FragmentsPerOrder;
-                int **OrderSet;
+  public:
+    int **KeySets;
+    int *AtomCounter;
+    int FragmentCounter;
+    int Order;
+    int *FragmentsPerOrder;
+    int **OrderSet;
 
-        KeySetsContainer();
-        ~KeySetsContainer();
+  KeySetsContainer();
+  ~KeySetsContainer();
 
-        bool ParseKeySets(const char *name, const int *ACounter, const int FCounter);
-        bool ParseManyBodyTerms();
-        bool Contains(const int GreaterSet, const int SmallerSet);
+  bool ParseKeySets(const char *name, const int *ACounter, const int FCounter);
+  bool ParseManyBodyTerms();
+  bool Contains(const int GreaterSet, const int SmallerSet);
 };