add_molforms: Add molecular formula objects

In EMSL-Computing/pspecterlib: PSpecteR Library - Visualization tools for top-down and bottom-up proteomics data

Add molecular formula objects

Description

Add molform objects together

Usage

add_molforms(..., CapNegatives = TRUE)

Arguments

...	Any number of molform objects from as.molform.
CapNegatives	A TRUE/FALSE to indicate whether negative elements should be capped at 0. Useful for modifications where elements are lost. Default is TRUE.

Examples

## Not run: 

add_molforms(as.molform("C6H12O6"), as.molform("H2K2F2Na5"), as.molform("H-1C-2"))


## End(Not run)

EMSL-Computing/pspecterlib documentation built on Jan. 28, 2024, 8:13 p.m.