test_class.declarator: builder = SilentChemObjectBuilder.getInstance()
test_class.modifier: private
test_class.original_string: private IChemObjectBuilder      builder = SilentChemObjectBuilder.getInstance();
test_class.type: IChemObjectBuilder
test_class.var_name: builder
test_class.declarator: lpcheck = new LonePairElectronChecker()
test_class.modifier: private
test_class.original_string: private LonePairElectronChecker lpcheck = new LonePairElectronChecker();
test_class.type: LonePairElectronChecker
test_class.var_name: lpcheck
test_class.file: tool/charges/src/test/java/org/openscience/cdk/charges/PiElectronegativityTest.java
test_class.identifier: PiElectronegativityTest
test_class.superclass: extends CDKTestCase
test_case.body: @Test
      public void testGetMaxResonStruc() throws Exception {
  
          PiElectronegativity pe = new PiElectronegativity();
          Assert.assertSame(50, pe.getMaxResonStruc());
      }
test_case.class_method_signature: PiElectronegativityTest.testGetMaxResonStruc()
test_case.full_signature: @Test public void testGetMaxResonStruc()
test_case.identifier: testGetMaxResonStruc
test_case.invocations: assertSame getMaxResonStruc
test_case.modifiers: @Test public
test_case.parameters: ()
test_case.return: void
test_case.signature: void testGetMaxResonStruc()
focal_class.declarator: peoe  = null
focal_class.modifier: private
focal_class.original_string: private GasteigerMarsiliPartialCharges peoe  = null;
focal_class.type: GasteigerMarsiliPartialCharges
focal_class.var_name: peoe
focal_class.declarator: pepe  = null
focal_class.modifier: private
focal_class.original_string: private GasteigerPEPEPartialCharges    pepe  = null;
focal_class.type: GasteigerPEPEPartialCharges
focal_class.var_name: pepe
focal_class.declarator: maxI  = 6
focal_class.modifier: private
focal_class.original_string: private int                            maxI  = 6;
focal_class.type: int
focal_class.var_name: maxI
focal_class.declarator: maxRS = 50
focal_class.modifier: private
focal_class.original_string: private int                            maxRS = 50;
focal_class.type: int
focal_class.var_name: maxRS
focal_class.declarator: molPi
focal_class.modifier: private
focal_class.original_string: private IAtomContainer                 molPi;
focal_class.type: IAtomContainer
focal_class.var_name: molPi
focal_class.declarator: acOldP
focal_class.modifier: private
focal_class.original_string: private IAtomContainer                 acOldP;
focal_class.type: IAtomContainer
focal_class.var_name: acOldP
focal_class.declarator: gasteigerFactors
focal_class.modifier: private
focal_class.original_string: private double[][]                     gasteigerFactors;
focal_class.type: double[][]
focal_class.var_name: gasteigerFactors
focal_class.declarator: logger = LoggingToolFactory.createLoggingTool(PiElectronegativity.class)
focal_class.modifier: private final
focal_class.original_string: private final ILoggingTool logger = LoggingToolFactory.createLoggingTool(PiElectronegativity.class);
focal_class.type: ILoggingTool
focal_class.var_name: logger
focal_class.file: tool/charges/src/main/java/org/openscience/cdk/charges/PiElectronegativity.java
focal_class.identifier: PiElectronegativity
focal_class.class_method_signature: PiElectronegativity.PiElectronegativity()
focal_class.full_signature: public  PiElectronegativity()
focal_class.identifier: PiElectronegativity
focal_class.modifiers: public
focal_class.parameters: ()
focal_class.signature:  PiElectronegativity()
focal_class.class_method_signature: PiElectronegativity.PiElectronegativity(int maxIterations, int maxResonStruc)
focal_class.full_signature: public  PiElectronegativity(int maxIterations, int maxResonStruc)
focal_class.identifier: PiElectronegativity
focal_class.modifiers: public
focal_class.parameters: (int maxIterations, int maxResonStruc)
focal_class.signature:  PiElectronegativity(int maxIterations, int maxResonStruc)
focal_class.class_method_signature: PiElectronegativity.calculatePiElectronegativity(IAtomContainer ac, IAtom atom)
focal_class.full_signature: public double calculatePiElectronegativity(IAtomContainer ac, IAtom atom)
focal_class.identifier: calculatePiElectronegativity
focal_class.modifiers: public
focal_class.parameters: (IAtomContainer ac, IAtom atom)
focal_class.return: double
focal_class.signature: double calculatePiElectronegativity(IAtomContainer ac, IAtom atom)
focal_class.class_method_signature: PiElectronegativity.calculatePiElectronegativity(IAtomContainer ac, IAtom atom, int maxIterations, int maxResonStruc)
focal_class.full_signature: public double calculatePiElectronegativity(IAtomContainer ac, IAtom atom, int maxIterations, int maxResonStruc)
focal_class.identifier: calculatePiElectronegativity
focal_class.modifiers: public
focal_class.parameters: (IAtomContainer ac, IAtom atom, int maxIterations, int maxResonStruc)
focal_class.return: double
focal_class.signature: double calculatePiElectronegativity(IAtomContainer ac, IAtom atom, int maxIterations, int maxResonStruc)
focal_class.class_method_signature: PiElectronegativity.setMaxIterations(int maxIterations)
focal_class.full_signature: public void setMaxIterations(int maxIterations)
focal_class.identifier: setMaxIterations
focal_class.modifiers: public
focal_class.parameters: (int maxIterations)
focal_class.return: void
focal_class.signature: void setMaxIterations(int maxIterations)
focal_class.class_method_signature: PiElectronegativity.setMaxResonStruc(int maxResonStruc)
focal_class.full_signature: public void setMaxResonStruc(int maxResonStruc)
focal_class.identifier: setMaxResonStruc
focal_class.modifiers: public
focal_class.parameters: (int maxResonStruc)
focal_class.return: void
focal_class.signature: void setMaxResonStruc(int maxResonStruc)
focal_class.class_method_signature: PiElectronegativity.getMaxIterations()
focal_class.full_signature: public int getMaxIterations()
focal_class.identifier: getMaxIterations
focal_class.modifiers: public
focal_class.parameters: ()
focal_class.return: int
focal_class.signature: int getMaxIterations()
focal_class.class_method_signature: PiElectronegativity.getMaxResonStruc()
focal_class.full_signature: public int getMaxResonStruc()
focal_class.identifier: getMaxResonStruc
focal_class.modifiers: public
focal_class.parameters: ()
focal_class.return: int
focal_class.signature: int getMaxResonStruc()
focal_method.body: public int getMaxResonStruc() {
          return maxRS;
      }
focal_method.class_method_signature: PiElectronegativity.getMaxResonStruc()
focal_method.full_signature: public int getMaxResonStruc()
focal_method.identifier: getMaxResonStruc
focal_method.modifiers: public
focal_method.parameters: ()
focal_method.return: int
focal_method.signature: int getMaxResonStruc()