get.stereocenters: Identify which atoms are stereocenters.

View source: R/stereo.R

get.stereocentersR Documentation

Identify which atoms are stereocenters.

Description

This method identifies stereocenters based on connectivity.

Usage

get.stereocenters(mol)

Arguments

mol

A jObjRef representing an IAtomContainer

Value

A logical vector of length equal in length to the number of atoms. The i'th element is TRUE if the i'th element is identified as a stereocenter

Author(s)

Rajarshi Guha rajarshi.guha@gmail.com

See Also

get.element.types, get.stereo.types


rcdk documentation built on Sept. 26, 2022, 5:09 p.m.