Package ambit2.descriptors.constitutional

Class Summary

Class	Description
AbstractAtomCountDescriptor
AtomCountHybridizationDescriptor	Atomistic topological indices.
AtomCountRelativeDescriptor	Relative atom-type count.
AverageMolecularWeightDescriptor	Average molecular weight.
CubicRootMolecularWeightDescriptor	Cubic root molecular weight.
DerivedMolecularWeightDescriptor	Parent class for molecular weight related descriptors
HeteroAtomCountDescriptor	Number of atoms which are not hydrogens and carbons .
RotatableBondFractionDescriptor	Rotatable bond fraction.
SquareRootMolecularWeightDescriptor	Square root molecular weight.