Interface IAtomTypeGuesser

All Known Implementing Classes:
StructGenAtomTypeGuesser

public interface IAtomTypeGuesser
Classes that implement this interface are atom type guessers. As compared to the IAtomTypeMatcher, this guesser has room for missing information. Not uncommonly, one bit of information is missing.
Author:
egonw
See Also:
Source code:
main
Belongs to CDK module:
core
Created on:
2006-09-22
  • Method Summary

    Modifier and Type
    Method
    Description
    Method that returns an iterator with a suitable list of atom types given the provided atom.
  • Method Details

    • possibleAtomTypes

      List<IAtomType> possibleAtomTypes(IAtomContainer container, IAtom atom) throws CDKException
      Method that returns an iterator with a suitable list of atom types given the provided atom.
      Parameters:
      container - AtomContainer of which the atom is part
      atom - Atom for which a matching atom type is searched
      Returns:
      The matching AtomTypes
      Throws:
      CDKException - when something went wrong with going through the AtomType's