Preprocessing and feature extraction

rIDIMS

rIDIMS processes direct-infusion MS by selecting usable scans, forming consensus spectra and filtering features with replicate and background information.

Direct-infusion MSR packageWeb applicationOpen source

Overview

rIDIMS processes direct-infusion MS by selecting usable scans, forming consensus spectra and filtering features with replicate and background information. Its R/Shiny workflow exports intermediate tables and reports for reviewing processing choices.

What can this tool do?

Blank and contaminant filteringInteractive dashboardReference-spectrum selection

Common uses

  • rIDIMS processes direct-infusion MS by selecting usable scans, forming consensus spectra and filtering features with replicate and background information.

Scientific fit

Primary function

Preprocessing and feature extraction

Other functions

Quality control and filtering, Visualization and reporting

Data compatibility

Inputs

Raw instrument data, Mass spectra

Outputs

Mass spectra, Feature or peak table

Input formats

Direct-infusion mzML files and sample-info XLSX metadata

Output formats

Processed/intermediate CSV tables, HTML report and text logs

Scope and considerations

Designed for

  • rIDIMS processes direct-infusion MS by selecting usable scans, forming consensus spectra and filtering features with replicate and background information.

Not designed for

  • Treating scan subsets from one injection as independent biological or experimental replicates.

Important requirements

  • R with documented dependencies, mzML files and a completed sample-information spreadsheet identifying classes, blanks and replicate groups.

Considerations

  • In-silico scan groups represent technical subdivisions of the same sample. Inspect scan selection, thresholds and blank filtering; the published online tutorial includes a package-loading error and is not proof of current operability.

Access and documentation

GPL-3.0-or-later source distribution. External datasets, dependent packages and any hosted routes retain their own terms; software operation was not tested.

License: GPL-3.0-or-later

Evidence and review

Enveda intake rechecked against official repository documentation, package/license metadata and primary publication identity on 2026-10-27. Editorial source review only; no software execution or independent benchmark. See docs/enveda-expansion-review-2026-10-27-batch3.md.

Core publications

Resource papers, direct updates and tool-specific methods. Selection policy.

  1. rIDIMS: A novel tool for processing direct-infusion mass spectrometry data. Talanta (2025). doi:10.1016/j.talanta.2024.127273

Related tools

Entry history

Changes to this catalogue entry, not the tool's software release history. Acceptance and editorial review are separate.

  1. 2026-10-27 · First committed entry

    Add 45 source-reviewed Enveda tool entries in third expansion batch

    View change · Entry at this revision

Full GitHub history