PotentialCalculationpublic class PotentialCalculationPhiSum extends java.lang.Object implements PotentialCalculation
| Modifier and Type | Field | Description |
|---|---|---|
protected AtomLeafAgentManager<MoleculeAgent> |
leafAgentManager |
| Constructor | Description |
|---|---|
PotentialCalculationPhiSum() |
| Modifier and Type | Method | Description |
|---|---|---|
void |
doCalculation(IAtomList atoms,
IPotentialAtomic potential) |
Method giving the specific calculation performed by this class.
|
void |
reset() |
|
void |
setAgentManager(AtomLeafAgentManager agentManager) |
protected AtomLeafAgentManager<MoleculeAgent> leafAgentManager
public void doCalculation(IAtomList atoms, IPotentialAtomic potential)
PotentialCalculationdoCalculation in interface PotentialCalculationatoms - IAtomSet the atom sets for which the calculation is performed.potential - The potential used to apply the action defined by this class.public void setAgentManager(AtomLeafAgentManager agentManager)
public void reset()