Class DescriptorWalkCount

java.lang.Object
qsardes.descriptor.DescriptorWalkCount
All Implemented Interfaces:
Descriptor
Direct Known Subclasses:
QsarMEWalkCount, QsarWBWalkCount

public abstract class DescriptorWalkCount extends Object implements Descriptor
Walk count descriptors abstract class.
  • Constructor Details

    • DescriptorWalkCount

      protected DescriptorWalkCount()
  • Method Details

    • toString

      public String toString()
      Overrides:
      toString in class Object
    • get_descriptor_type

      public DescriptorType get_descriptor_type()
      Description copied from interface: Descriptor
      Gets the descriptor class type.
      Specified by:
      get_descriptor_type in interface Descriptor
      Returns:
      Descriptor class type.
    • get_descriptor_names

      public List<String> get_descriptor_names()
      Description copied from interface: Descriptor
      Gets descriptors names.
      Specified by:
      get_descriptor_names in interface Descriptor
      Returns:
      Descriptor names.
    • get_descriptor_values

      public Map<String,String> get_descriptor_values(AbstractMoleculeBuilder mol_build)
      Description copied from interface: Descriptor
      Calculates descriptors values.
      Specified by:
      get_descriptor_values in interface Descriptor
      Parameters:
      mol_build - Molecular builder representation.
      Returns:
      Descriptor values mapped as name:value.
    • calculate_tsrw

      protected abstract double calculate_tsrw(int diag_value)
    • get_tsrw

      protected abstract double get_tsrw(double tsrw)