Package qsardes.descriptor

Class DescriptorInformationContent

java.lang.Object
qsardes.descriptor.DescriptorInformationContent
All Implemented Interfaces:
Descriptor
Direct Known Subclasses:
QsarMEInformationContent, QsarWBInformationContent
public abstract class DescriptorInformationContent extends Object implements Descriptor
Information content descriptors abstract class.

  • Constructor Details

    • DescriptorInformationContent

      protected DescriptorInformationContent()

  • Method Details

    • toString

      public String toString()
      Overrides:
      toString in class Object

    • 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.

    • 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_aromatic_info

      protected abstract String get_aromatic_info(org.openscience.cdk.interfaces.IAtomContainer iac, org.openscience.cdk.interfaces.IAtom atom_p, org.openscience.cdk.interfaces.IAtom atom_i)