RMassBank (version 2.0.0)

mbWorkspace-class: Workspace for mbWorkflow data

Description

A workspace which stores input and output data for use with mbWorkflow.

Usage

"show"(object)

Arguments

object

The mbWorkspace to display.

Details

Slots:

spectra, aggregated

The corresponding input data from msmsWorkspace-class

additionalPeaks

A list of additional peaks which can be loaded using addPeaks.

mbdata, mbdata_archive, mbdata_relisted

Infolist data: Data for annotation of MassBank records, which can be loaded using loadInfolists.

compiled, compiled_ok

Compiled tree-structured MassBank records. compiled_ok contains only the compounds with at least one valid spectrum.

mbfiles

Compiled MassBank records in text representation.

molfile

MOL files with the compound structures.

ok,problems

Index lists for internal use which denote which compounds have valid spectra.

Methods:

show

Shows a brief summary of the object. Currently only a stub.

See Also

mbWorkflow