recipe bioconductor-tartare

Raw ground spectra recorded on Thermo Fisher Scientific mass spectrometers

Homepage:

https://bioconductor.org/packages/3.20/data/experiment/html/tartare.html

License:

GPL-3

Recipe:

/bioconductor-tartare/meta.yaml

Provides raw files recorded on different Liquid Chromatography Mass Spectrometry (LC-MS) instruments. All included MS instruments are manufactured by Thermo Fisher Scientific and belong to the Orbitrap Tribrid or Q Exactive Orbitrap family of instruments. Despite their common origin and shared hardware components, e.g., Orbitrap mass analyser, the above instruments tend to write data in different "dialects" in a shared binary file format (.raw). The intention behind tartare is to provide complex but slim real-world files that can be used to make code robust with respect to this diversity. In other words, it is intended for enhanced unit testing. The package is considered to be used with the rawrr package and the Spectra MsBackends.

package bioconductor-tartare

(downloads) docker_bioconductor-tartare

Versions:
1.24.0-0,  1.20.0-0,  1.16.0-0,  1.14.0-0,  1.12.0-0,  1.8.0-1,  1.8.0-0,  1.6.0-0,  1.4.0-1, 

1.24.0-0,  1.20.0-0,  1.16.0-0,  1.14.0-0,  1.12.0-0,  1.8.0-1,  1.8.0-0,  1.6.0-0,  1.4.0-1,  1.4.0-0,  1.2.0-0,  0.99.14-1

Depends:

  • on bioconductor-annotationhub >=4.0.0,<4.1.0

  • on bioconductor-data-packages >=20260207

  • on bioconductor-experimenthub >=3.0.0,<3.1.0

  • on curl

  • on r-base >=4.5,<4.6.0a0

Additional platforms:

Installation

You need a conda-compatible package manager (currently either pixi, conda, or micromamba) and the Bioconda channel already activated (see Usage). Below, we show how to install with either pixi or conda (for micromamba and mamba, commands are essentially the same as with conda).

Pixi

With pixi installed and the Bioconda channel set up (see Usage), to install globally, run:

pixi global install bioconductor-tartare

to add into an existing workspace instead, run:

pixi add bioconductor-tartare

In the latter case, make sure to first add bioconda and conda-forge to the channels considered by the workspace:

pixi workspace channel add conda-forge
pixi workspace channel add bioconda

Conda

With conda installed and the Bioconda channel set up (see Usage), to install into an existing and activated environment, run:

conda install bioconductor-tartare

Alternatively, to install into a new environment, run:

conda create -n envname bioconductor-tartare

with envname being the name of the desired environment.

Container

Alternatively, every Bioconda package is available as a container image for usage with your preferred container runtime. For e.g. docker, run:

docker pull quay.io/biocontainers/bioconductor-tartare:<tag>

(see bioconductor-tartare/tags for valid values for <tag>).

Integrated deployment

Finally, note that many scientific workflow management systems directly integrate both conda and container based software deployment. Thus, workflow steps can be often directly annotated to use the package, leading to automatic deployment by the respective workflow management system, thereby improving reproducibility and transparency. Check the documentation of your workflow management system to find out about the integration.

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