rMSIproc
rMSIproc processes mass spectrometry imaging (MSI) data from time-of-flight (TOF) and Fourier transform (FT) mass spectrometers to convert raw spectral datasets into analyzable biochemical information.
Key Features:
- Full Data Processing Workflow: Implements a complete workflow from raw spectral data to analyzable biochemical outputs for MSI experiments.
- Spectral Alignment and Recalibration: Implements a spectral alignment and recalibration strategy that enables simultaneous processing of multiple datasets to improve consistency and mass accuracy.
- Statistical Analysis Capability: Supports concurrent processing of multiple datasets from single or multiple experiments to enable robust statistical analyses.
- Efficient Handling of Large Datasets: Manages and processes MSI datasets that can exceed computer memory capacity through memory-efficient data handling.
- Multi-threading Strategy: Implements algorithms using a multi-threading strategy to optimize processing speed and resource utilization.
Scientific Applications:
- Oncology: Enables detailed biochemical analysis of tissue sections to investigate disease mechanisms in cancer research.
- Pharmacology: Supports analysis of drug distribution and tissue pharmacology by mapping compounds within tissue sections.
- Neurobiology: Facilitates metabolic and biochemical mapping in neural tissues to study metabolic processes and molecular distributions.
Methodology:
Computational methods explicitly include a spectral alignment and recalibration strategy, support for simultaneous processing of multiple datasets, memory-efficient handling for datasets exceeding RAM, and algorithms implemented with a multi-threading strategy.
Topics
Details
- Programming Languages:
- R
- Added:
- 1/18/2021
- Last Updated:
- 2/7/2021
Operations
Publications
Ràfols P, Heijs B, del Castillo E, Yanes O, McDonnell LA, Brezmes J, Pérez-Taboada I, Vallejo M, García-Altares M, Correig X. rMSIproc: an R package for mass spectrometry imaging data processing. Bioinformatics. 2020;36(11):3618-3619. doi:10.1093/bioinformatics/btaa142. PMID:32108859.