set.charge.formula: set.charge.formula

View source: R/formula.R

set.charge.formulaR Documentation

set.charge.formula

Description

Set the charge to a cdkFormula function.

Usage

set.charge.formula(formula, charge = -1)

Arguments

formula

Required. Molecular formula

charge

Optional. Default -1


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