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rcdk (version 2.4)

get.desc.classnames: Get Descriptor Class Names

Description

The CDK implements a number of descriptors divided into three main groups - atomic, molecular and bond. This method uses a CDK Object of class DescriptorEngine to get the class names of all descriptors of a specific type. The class names can then be used to obtain descriptor values for a molecule.

Usage

get.desc.classnames(dengine)

Arguments

dengine
A reference to a CDK DescriptorEngine object

Value

  • A character vector of descriptor class names

See Also

get.desc.classnames, eval.desc, get.desc.values