org.jmol.smiles
public class SmilesMolecule extends Object
| Field Summary | |
|---|---|
| SmilesAtom[] | atoms |
| int | atomsCount |
| SmilesBond[] | bonds |
| int | bondsCount |
| static int | INITIAL_ATOMS |
| static int | INITIAL_BONDS |
| Constructor Summary | |
|---|---|
| SmilesMolecule()
SmilesMolecule constructor | |
| Method Summary | |
|---|---|
| SmilesAtom | createAtom() |
| SmilesBond | createBond(SmilesAtom atom1, SmilesAtom atom2, int bondType) |
| SmilesAtom | getAtom(int number) |
| int | getAtomsCount() |
| SmilesBond | getBond(int number) |
| int | getBondsCount() |