exactMass_OB {ChemmineOB} | R Documentation

## Exact Mass (Monoisotopic Mass)

### Description

Computes the exact mass of each compound given.

### Usage

    exactMass_OB(obmolRefs)

### Arguments

`obmolRefs` | A list of OBMol references ( of class '_p_OpenBabel__OBMol') representing the compounds.

### Value

A vector of mass values.

### Author(s)

Kevin Horan

### Examples

    	molRefs = forEachMol("SMILES","C1CCCCC1\ttest-compound-name",identity)
    	exactMass_OB(molRefs)

[Package ChemmineOB version 1.24.0 Index]