Package com.chemaxon.descriptors.alignment

package com.chemaxon.descriptors.alignment

3D flexible alignment based molecular shape similarity calculation.

Class	Description
AbstractShapeComparator<T extends ShapeDescriptor>
AbstractShapeGenerator<D extends ShapeDescriptor,P extends AbstractShapeGeneratorParameter>
AbstractShapeGeneratorParameter	Helper class without the requested getDescriptorGenerator method.
AtomTyping	Settings for shape associated atom typing.
BaseShapeComparatorParameter
DRShapeDescriptor	Descriptor (serialized data) for the Distance range assisted shape alignment comparison.
DRShapeMetrics	Metrics for distance range assisted shape comparison.
FlexibilityModeParameterBuilder
ShapeComparator<T extends ShapeDescriptor>
ShapeComparatorException
ShapeComparisonResult	Flexible alignment based shape descriptor calculation
ShapeDescriptor
ShapeFunction
ShapeGeneratorException
ShapeMetrics