public interface Molecule
Modifier and Type | Method and Description |
---|---|
java.util.List<Atom> |
getAtoms()
get all atoms in the molecule
|
Coord |
getCenterOfMass()
get the center of mass of this molecule.
|
int |
getIndex()
get the index of molecule in the molecular system
|
Region.Name |
getName()
get the name of molecule.
|
void |
setCenterOfMass(Coord centerOfMass)
set the center of mass of this molecule.
|
void |
setName(Region.Name name)
set the name of molecule.
|
Region.Name getName()
Region.Name
void setName(Region.Name name)
name
- -indicates which the molecule is in,
Region.Name
java.util.List<Atom> getAtoms()
Atom
int getIndex()
Integer
Coord getCenterOfMass()
Coord