ftmsRanalysis
"ftmsRanalysis" is an R package specifically developed to meet the analytical needs of researchers utilizing Fourier transform mass spectrometry (FT-MS) data. FT-MS is renowned for its high resolution and mass accuracy. It is a preferred method for analyzing complex mixtures of organic compounds such as proteins, carbohydrates, lipids, and other chemical entities found in soil, plant, and aquatic samples. The technique is crucial for understanding these mixtures' composition and chemical properties, including the availability of carbon compounds for oxidation processes.
Key Features of ftmsRanalysis:
- Comprehensive Data Analysis Toolkit: ftmsRanalysis is designed to support the entire data analysis workflow for FT-MS data, including data formatting and processing, filtering, and sample and group comparison functionalities. This comprehensive approach ensures that researchers can effectively manage and analyze their data within a single package.
- Advanced Visualization Capabilities: One of the standout features of ftmsRanalysis is its extensive suite of plotting methods, which facilitate the creation of interactive visualizations. This feature is valuable for exploring complex datasets, allowing researchers to gain deeper insights into their data.
- Integration with Trelliscope: The package offers functions that link to Trelliscope, a powerful and interactive visualization user interface. This integration enables users to produce highly interactive visualizations, enhancing the interpretability and presentation of FT-MS data analysis results.
- Facilitates Sample and Group Comparisons: ftmsRanalysis includes functionalities that aid in comparing fundamental chemical properties of complex samples across different groups. This capability is essential for studies aiming to discern variations in sample composition under various experimental or environmental conditions.
Topic
Microbiology;Proteomics experiment;Carbohydrates;Plant biology;Informatics
Detail
Operation: Visualisation;Filtering;Parsing;Peak detection
Software interface: Library
Language: R
License: Other
Cost: Free
Version name: 1.1.0
Credit: Environmental Molecular Sciences Laboratory, Office of Biological and Environmental Research, Microbiomes in Transition Initiative Laboratory Directed Research and Development Program, Pacific Northwest National Laboratory, Battelle, U.S. DOE.
Input: -
Output: -
Contact: Lisa M. Bramer lisa.bramer@pnnl.gov
Collection: -
Maturity: Stable
Publications
- ftmsRanalysis: An R package for exploratory data analysis and interactive visualization of FT-MS data.
- Bramer LM, et al. ftmsRanalysis: An R package for exploratory data analysis and interactive visualization of FT-MS data. ftmsRanalysis: An R package for exploratory data analysis and interactive visualization of FT-MS data. 2020; 16:e1007654. doi: 10.1371/journal.pcbi.1007654
- https://doi.org/10.1371/JOURNAL.PCBI.1007654
- PMID: 32176690
- PMC: PMC7098629
Download and documentation
Source: https://github.com/EMSL-Computing/ftmsRanalysis/releases/tag/1.1.0
Documentation: https://github.com/EMSL-Computing/ftmsRanalysis/blob/master/README.md
Links: https://github.com/EMSL-Computing/ftmsRanalysis/tree/master/inst/doc
Links: https://github.com/EMSL-Computing/ftmsRanalysis/blob/master/LICENSE
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