get.charge

atom

Get the charge on the atom.
This method returns the partial charge on the atom. If charges have not been set the
return value is <code>NULL</code>, otherwise the appropriate charge.

Allows the user to access functionality in the
'CDK', a Java framework for chemoinformatics. This allows the user to load
molecules, evaluate fingerprints, calculate molecular descriptors and so on.
In addition, the 'CDK' API allows the user to view structures in 2D.

Zachary CharlopPowers

rcdk

Interface to the 'CDK' Libraries

Rajarshi Guha

Zachary Charlop-Powers

Emma Schymanski

get.charge function

Get the charge on the atom.

This method returns the partial charge on the atom. If charges have not been set the
return value is <code>NULL</code>, otherwise the appropriate charge. — get.charge

Get the charge on the atom.

This method returns the partial charge on the atom. If charges have not been set the
return value is <code>NULL</code>, otherwise the appropriate charge.

Get the charge on the atom.This method returns the partial charge on the atom. If charges have not been set the
return value is <code>NULL</code>, otherwise the appropriate charge.

get.charge: Get the charge on the atom.
This method returns the partial charge on the atom. If charges have not been set the return value is `NULL`, otherwise the appropriate charge.

Description

Usage

Arguments

Value

See Also