Daylight v4.9
Release Date: 1 February 2008

Name

dt_getmap - find all the atoms in a map class

Generic Prototype

dt_getmap(dt_Handle) => dt_Handle

C Prototype

#include "dt_smiles.h"

dt_Handle dt_getmap(dt_Handle atom)

FORTRAN Prototype

include 'dt_f_smiles.inc'

integer*4 dt_f_getmap(atom)

integer*4 atom

Description

Finds all atoms in the same map class set as the given atom and returns them in a substruct. Note that the substruct will contain the given atom as one of the members, in no particular order.

Return Value

Returns a substruct containing atoms which are in the same map class set as the given atom or NULL_OB if the atom is not part of a reaction or if the atom is the lone member of its map class set.

Related Topics

dt_mapped(3) dt_setmap(3)