IMolecularModel_SpeciesFactory, java.lang.Cloneablepublic class MolecularModelLJQ_SpeciesLJ extends java.lang.Object implements IMolecularModel_SpeciesFactory, java.lang.Cloneable
| Constructor | Description |
|---|---|
MolecularModelLJQ_SpeciesLJ() |
| Modifier and Type | Method | Description |
|---|---|---|
java.lang.Object |
clone() |
|
ISpecies |
createSpecies() |
|
java.lang.String[][] |
getComponentValues() |
|
java.lang.String |
getDescription(java.lang.String Parameter) |
|
java.lang.Double |
getDoubleDefaultParameters(java.lang.String Parameter) |
|
double |
getEpsilon(int index) |
|
int |
getId() |
|
java.lang.String |
getMolecularModelDisplayName() |
|
java.lang.String |
getMoleculeDisplayName() |
|
double |
getMomentSquare(int index) |
|
java.lang.String |
getNonBondedInteractionModel() |
|
java.lang.String[][] |
getParamAndValues() |
|
int |
getParameterCount() |
|
java.lang.String[] |
getParametersArray() |
|
java.lang.Class |
getPotential() |
|
java.lang.String |
getPotentialSiteAtIndex(int index) |
|
java.lang.String[] |
getPotentialSites() |
|
double |
getSigma(int index) |
|
double |
getSigmaHSRef() |
|
Space |
getSpace() |
|
boolean |
hasElectrostaticInteraction() |
|
static void |
main(java.lang.String[] args) |
|
void |
setComponentValues(java.lang.String[][] componentValues) |
|
void |
setEpsilon(double epsilon,
int index) |
|
void |
setMomentSquare(double momentSquare,
int index) |
|
void |
setParameter(java.lang.String Parameter,
java.lang.String ParameterValue) |
|
void |
setSigma(double sigma,
int index) |
|
void |
setSigmaHSRef(double sigmaHSRef) |
public int getId()
public double getSigmaHSRef()
public void setSigmaHSRef(double sigmaHSRef)
public java.lang.String[][] getComponentValues()
public void setComponentValues(java.lang.String[][] componentValues)
public java.lang.String[][] getParamAndValues()
getParamAndValues in interface IMolecularModel_SpeciesFactorypublic java.lang.Object clone()
clone in interface IMolecularModel_SpeciesFactoryclone in class java.lang.Objectpublic ISpecies createSpecies()
createSpecies in interface IMolecularModel_SpeciesFactorypublic static void main(java.lang.String[] args)
public double getSigma(int index)
public void setSigma(double sigma,
int index)
public double getEpsilon(int index)
public void setEpsilon(double epsilon,
int index)
public double getMomentSquare(int index)
public void setMomentSquare(double momentSquare,
int index)
public int getParameterCount()
getParameterCount in interface IMolecularModel_SpeciesFactorypublic void setParameter(java.lang.String Parameter,
java.lang.String ParameterValue)
setParameter in interface IMolecularModel_SpeciesFactorypublic java.lang.String getDescription(java.lang.String Parameter)
getDescription in interface IMolecularModel_SpeciesFactorypublic java.lang.Double getDoubleDefaultParameters(java.lang.String Parameter)
getDoubleDefaultParameters in interface IMolecularModel_SpeciesFactorypublic java.lang.String[] getParametersArray()
getParametersArray in interface IMolecularModel_SpeciesFactorypublic java.lang.String getMolecularModelDisplayName()
getMolecularModelDisplayName in interface IMolecularModel_SpeciesFactorypublic java.lang.String[] getPotentialSites()
getPotentialSites in interface IMolecularModel_SpeciesFactorypublic java.lang.String getPotentialSiteAtIndex(int index)
getPotentialSiteAtIndex in interface IMolecularModel_SpeciesFactorypublic java.lang.String getMoleculeDisplayName()
getMoleculeDisplayName in interface IMolecularModel_SpeciesFactorypublic java.lang.Class getPotential()
getPotential in interface IMolecularModel_SpeciesFactorypublic Space getSpace()
getSpace in interface IMolecularModel_SpeciesFactorypublic boolean hasElectrostaticInteraction()
hasElectrostaticInteraction in interface IMolecularModel_SpeciesFactorypublic java.lang.String getNonBondedInteractionModel()
getNonBondedInteractionModel in interface IMolecularModel_SpeciesFactory