| get.charge {rcdk} | R Documentation |
get.charge
Description
Get the charge on the atom.
Usage
get.charge(atom)
Arguments
atom |
The atom to query |
Details
This method returns the partial charge on the atom. If charges have not been set the
return value is NULL, otherwise the appropriate charge.
Value
An numeric representing the partial charge. If charges have not been set, 'NULL' is returned
Author(s)
Rajarshi Guha (rajarshi.guha@gmail.com)
See Also
[Package rcdk version 3.8.1 Index]