Affiliation:
1. State Key Laboratory of Crop Stress Adaptation and Improvement, Henan Joint International Laboratory for Crop Multi‐Omics Research, School of Life Sciences Henan University Kaifeng 475004 China
2. Thermo Fisher Scientific Shanghai 201206 China
3. Waters Technologies Shanghai Ltd Shanghai 201206 China
4. Institute of Biological, Environmental and Rural Sciences Aberystwyth University Aberystwyth SY23 3FL UK
5. Faculty of Science and Engineering, School of Biological & Marine Sciences University of Plymouth PL4 8AA UK
Abstract
ABSTRACTThe utilization of metabolomics approaches to explore the metabolic mechanisms underlying plant fitness and adaptation to dynamic environments is growing, highlighting the need for an efficient and user‐friendly toolkit tailored for analyzing the extensive datasets generated by metabolomics studies. Current protocols for metabolome data analysis often struggle with handling large‐scale datasets or require programming skills. To address this, we present MetMiner (https://github.com/ShawnWx2019/MetMiner), a user‐friendly, full‐functionality pipeline specifically designed for plant metabolomics data analysis. Built on R shiny, MetMiner can be deployed on servers to utilize additional computational resources for processing large‐scale datasets. MetMiner ensures transparency, traceability, and reproducibility throughout the analytical process. Its intuitive interface provides robust data interaction and graphical capabilities, enabling users without prior programming skills to engage deeply in data analysis. Additionally, we constructed and integrated a plant‐specific mass spectrometry database into the MetMiner pipeline to optimize metabolite annotation. We have also developed MDAtoolkits, which include a complete set of tools for statistical analysis, metabolite classification, and enrichment analysis, to facilitate the mining of biological meaning from the datasets. Moreover, we propose an iterative weighted gene co‐expression network analysis strategy for efficient biomarker metabolite screening in large‐scale metabolomics data mining. In two case studies, we validated MetMiner's efficiency in data mining and robustness in metabolite annotation. Together, the MetMiner pipeline represents a promising solution for plant metabolomics analysis, providing a valuable tool for the scientific community to use with ease.
Funder
National Natural Science Foundation of China
Biotechnology and Biological Sciences Research Council