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RMassBank

Bioc current

Workflow to process tandem MS files and build MassBank records

v3.22.0 · Package record · software · Artistic-2.0

Release Lineage

Entered 2.11 · Oct 3, 2012

Current · Requires R 4.6

1.0 In 28 of 49 releases 3.23

Description

Workflow to process tandem MS files and build MassBank records. Functions include automated extraction of tandem MS spectra, formula assignment to tandem MS fragments, recalibration of tandem MS spectra with assigned fragments, spectrum cleanup, automated retrieval of compound information from Internet databases, and export to MassBank records.

Advisories

None published for Bioconductor

Test coverage

Line coverage

–

Expression

–

Tests / Examples

–

Functions

210 125 exported

Complexity

5.2 avg / 51 max

Call network

210 nodes / 301 edges

Test coverage is not measured for Bioconductor packages; nodes fall back to a neutral fill.

Loading call graph…

Lowest coverage

Per-function coverage is not measured for this package yet.

Code

Structure

Lines of code

20,968

Files

184

Compiled share

0%

Has compiled src

No

Language breakdown

R 14,323 (68.3%)Tests 24 (0.1%)Docs 5,538 (26.4%)Vignettes 1,083 (5.2%)

API

Exported functions

141

Internal functions

85

Testing

Has tests

Yes

Test-to-code ratio

0.00

testthat edition

–

Docs

Roxygen coverage

100%

Health & Security signals

Informational signals; not verdicts.

on.exit coverage

10.5%

Unsafe pattern score

0

Dep constraint coverage

0%

Secret pattern count

0

Bundled 3rd-party code

2 items

Portability & License

Min R version

–

System requirements

1 externalOpenBabel

C++ standard

–

License

Artistic-2.0

License flags

SPDX valid, OSI approved

History

Versions

28

First release

2012-10-01

Latest release

2026-04-28

Avg cadence

182 days

Cold removal rate

100%

Dep drift

27

LOC over versions

v2.11: 7,976 LOCv2.12: 8,156 LOCv2.13: 10,461 LOCv2.14: 11,653 LOCv3.0: 11,630 LOCv3.1: 13,090 LOCv3.2: 13,090 LOCv3.3: 16,551 LOCv3.4: 16,551 LOCv3.5: 16,551 LOCv3.6: 16,559 LOCv3.7: 16,559 LOCv3.8: 16,573 LOCv3.9: 16,564 LOCv3.10: 16,568 LOCv3.11: 17,267 LOCv3.12: 19,036 LOCv3.13: 19,036 LOCv3.14: 19,286 LOCv3.15: 19,944 LOCv3.16: 19,944 LOCv3.17: 19,944 LOCv3.18: 20,319 LOCv3.19: 20,319 LOCv3.20: 20,968 LOCv3.21: 20,968 LOCv3.22: 20,968 LOCv3.23: 20,968 LOC

Per-file churn detail lives in the source pipeline: https://github.com/r-observatory/bioc-code-metrics.

Documentation

In the Bioconductor 3.23 release
READMEYes · 181 wordsVignettesYes · 2 · dynamicNEWSYes · 100% structuredCitation fileYes · cites a publicationWebsitenot declared in DESCRIPTION
Help pages
126
Examples that run
25%18 run in a plain check · 54 never run
Exported functions with examples
64%
Documented parameters
99%
Return-value docs
86%
Help pages citing references
16%

Repository practices

Bioconductor git repository

Checks read the Bioconductor git repository (git.bioconductor.org), branch RELEASE_3_23.

3 practices detected in the Bioconductor git repository

Continuous integration (3)
GitHub ActionsTravis CI (config file)PR checks

Topics

Maintainer
RMassBank at Eawag

Available on

CRANr2uBioconductorautoCRANCOPR

Suggested by (1)

People

Cite

Cite this package

Run in R for the authors' preferred citation:

citation("RMassBank")

The package provides a citation file that builds its entry when R runs it. Run citation() to see it.

Cite the R Observatory

For a number measured here: a download total, a coverage figure, an archival date.

APA

Balamuta, J. J. (2026). R Observatory: Metrics for RMassBank version 3.22.0 [Data set]. HJJB, LLC. Data release v2026-10-25. https://doi.org/10.5281/zenodo.21843040

From data release v2026-10-25, which the citation names so these numbers can be found later. More on citing and the projects behind them.

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