get.element.types: Obtain the type of stereo element support for atom.

View source: R/stereo.R

get.element.typesR Documentation

Obtain the type of stereo element support for atom.

Description

Supported elements types are

Bicoordinate

an central atom involved in a cumulated system (not yet supported)

Tricoordinate

an atom at one end of a geometric (double-bond) stereo bond or cumulated system

Tetracoordinate

a tetrahedral atom (could also be square planar in future)

None

the atom is not a (supported) stereo element type

Usage

get.element.types(mol)

Arguments

mol

A jObjRef representing an IAtomContainer

Value

A factor of length equal in length to the number of atoms, indicating the element type

Author(s)

Rajarshi Guha rajarshi.guha@gmail.com

See Also

get.stereocenters, get.stereo.types


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