Name | Description | Type | Package | Framework |
AtomicNumberDifferenceDescriptor | Describes the imbalance in atomic number of the IBond. | Class | org.openscience.cdk.qsar.descriptors.bond | CDK |
BondPartialPiChargeDescriptor | The calculation of bond-pi Partial charge is calculated determining the difference the Partial Pi Charge on atoms | Class | org.openscience.cdk.qsar.descriptors.bond | CDK |
BondPartialSigmaChargeDescriptor | The calculation of bond-sigma Partial charge is calculated determining the difference the Partial Sigma Charge on atoms | Class | org.openscience.cdk.qsar.descriptors.bond | CDK |
BondPartialTChargeDescriptor | The calculation of bond total Partial charge is calculated determining the difference the Partial Total Charge on atoms | Class | org.openscience.cdk.qsar.descriptors.bond | CDK |
BondSigmaElectronegativityDescriptor | The calculation of bond-Polarizability is calculated determining the difference the Sigma electronegativity on atoms A and B of a bond. | Class | org.openscience.cdk.qsar.descriptors.bond | CDK |
IPBondLearningDescriptor | This class returns the ionization potential of a Bond. | Class | org.openscience.cdk.qsar.descriptors.bond | CDK |