org.jmol.smiles
Class SmilesMolecule
java.lang.Object
org.jmol.smiles.SmilesMolecule
public class SmilesMolecule
- extends java.lang.Object
Molecule created from a SMILES String
Methods inherited from class java.lang.Object |
clone, equals, finalize, getClass, hashCode, notify, notifyAll, toString, wait, wait, wait |
atoms
private SmilesAtom[] atoms
atomsCount
private int atomsCount
bonds
private SmilesBond[] bonds
bondsCount
private int bondsCount
INITIAL_ATOMS
private static final int INITIAL_ATOMS
- See Also:
- Constant Field Values
INITIAL_BONDS
private static final int INITIAL_BONDS
- See Also:
- Constant Field Values
SmilesMolecule
public SmilesMolecule()
- SmilesMolecule constructor
createAtom
public SmilesAtom createAtom()
getAtomsCount
public int getAtomsCount()
getAtom
public SmilesAtom getAtom(int number)
createBond
public SmilesBond createBond(SmilesAtom atom1,
SmilesAtom atom2,
int bondType)
getBondsCount
public int getBondsCount()
getBond
public SmilesBond getBond(int number)