Case Study

To achieve the global identification of metabolomes including bacteria, plant, human host, microbiota, and exposome compounds.

To achieve the global identification of metabolomes including bacteria, plant, human host, microbiota, and exposome compounds.

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For Research Use Only. Not for use in diagnostic procedures. AB Sciex is operating as SCIEX. © 2019 AB Sciex. The trademarks mentioned herein are the property of the AB Sciex Pte. Ltd. or their respective owners. AB Sciex TM is being used under license. RUO-MKT-18-8969-A Case Study The Solution • Creating data processing software programs to efficiently extract metabolite ion features • Formulating the relationship between metabolite structures and mass fragmentations using enriched mass spectral databases • Creating new algorithms for predicting molecular formula, metabolite class (ontology), and structure The Outcomes • 12 informatics tools including MS-DIAL, MS-FINDER, and MRMPROBS that are published in “Computational metabolomics” section in RIKEN PRIMe (http://prime.

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