get.desc.classnames {rcdk}R Documentation

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

Author(s)

Rajarshi Guha (rguha@indiana.edu)

See Also

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


[Package rcdk version 2.6.1 Index]