Uses of Interface
com.actelion.research.chem.phesa.pharmacophore.IPharmacophorePoint
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Packages that use IPharmacophorePoint Package Description com.actelion.research.chem.phesa.pharmacophore -
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Uses of IPharmacophorePoint in com.actelion.research.chem.phesa.pharmacophore
Classes in com.actelion.research.chem.phesa.pharmacophore that implement IPharmacophorePoint Modifier and Type Class Description class
AcceptorPoint
class
AromRingPoint
class
ChargePoint
class
DonorPoint
Methods in com.actelion.research.chem.phesa.pharmacophore that return IPharmacophorePoint Modifier and Type Method Description IPharmacophorePoint
AcceptorPoint. copyPharmacophorePoint()
IPharmacophorePoint
AromRingPoint. copyPharmacophorePoint()
IPharmacophorePoint
ChargePoint. copyPharmacophorePoint()
IPharmacophorePoint
DonorPoint. copyPharmacophorePoint()
IPharmacophorePoint
IPharmacophorePoint. copyPharmacophorePoint()
static IPharmacophorePoint
PharmacophorePointFactory. fromString(java.lang.String ppString, StereoMolecule mol)
IPharmacophorePoint
PPGaussian. getPharmacophorePoint()
Methods in com.actelion.research.chem.phesa.pharmacophore that return types with arguments of type IPharmacophorePoint Modifier and Type Method Description java.util.ArrayList<IPharmacophorePoint>
IonizableGroupDetector. detect()
static java.util.List<IPharmacophorePoint>
PharmacophoreCalculator. getPharmacophorePoints(StereoMolecule mol)
Methods in com.actelion.research.chem.phesa.pharmacophore with parameters of type IPharmacophorePoint Modifier and Type Method Description double
AcceptorPoint. getSimilarity(IPharmacophorePoint pp)
double
AromRingPoint. getSimilarity(IPharmacophorePoint pp)
double
ChargePoint. getSimilarity(IPharmacophorePoint pp)
double
DonorPoint. getSimilarity(IPharmacophorePoint pp)
double
IPharmacophorePoint. getSimilarity(IPharmacophorePoint pp)
double
AromRingPoint. getVectorSimilarity(IPharmacophorePoint pp2)
double
AromRingPoint. getVectorSimilarity(IPharmacophorePoint pp2, Coordinates directionalityMod)
double
ChargePoint. getVectorSimilarity(IPharmacophorePoint pp2)
double
ChargePoint. getVectorSimilarity(IPharmacophorePoint pp2, Coordinates directionalityMod)
default double
IPharmacophorePoint. getVectorSimilarity(IPharmacophorePoint pp2)
default double
IPharmacophorePoint. getVectorSimilarity(IPharmacophorePoint pp2, Coordinates directionalityMod)
Constructors in com.actelion.research.chem.phesa.pharmacophore with parameters of type IPharmacophorePoint Constructor Description PPGaussian(int atomicNo, IPharmacophorePoint pp)
PPTriangle(IPharmacophorePoint pp1, IPharmacophorePoint pp2, IPharmacophorePoint pp3, double d12, double d13, double d23, Coordinates molCom)
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