is.neutral: Tests whether the molecule is neutral.
In rcdk: Interface to the 'CDK' Libraries
is.neutral R Documentation
Tests whether the molecule is neutral.
Description
The test checks whether all atoms in the molecule have a formal charge of 0.
Usage
is.neutral(mol)
Arguments
mol
The molecule to query. Should be a 'jobjRef' representing an 'IAtomContainer'
Value
'TRUE' if molecule is neutral, 'FALSE' otherwise
Author(s)
Rajarshi Guha (rajarshi.guha@gmail.com)
rcdk documentation built on July 9, 2023, 7:27 p.m.
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| is.neutral | R Documentation |
Tests whether the molecule is neutral.
Description
The test checks whether all atoms in the molecule have a formal charge of 0.
Usage
is.neutral(mol)
Arguments
mol |
The molecule to query. Should be a 'jobjRef' representing an 'IAtomContainer' |
Value
'TRUE' if molecule is neutral, 'FALSE' otherwise
Author(s)
Rajarshi Guha (rajarshi.guha@gmail.com)
R Package Documentation
Browse R Packages
We want your feedback!
Note that we can't provide technical support on individual packages. You should contact the package authors for that.
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