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Open Source Software Toolchain For Automated Non‐Targeted Screening For Toxins In Alternative Foods, S. W. Breuer, L. Toppen, S. K. Schum, J. M. Pearce Oct 2021

Open Source Software Toolchain For Automated Non‐Targeted Screening For Toxins In Alternative Foods, S. W. Breuer, L. Toppen, S. K. Schum, J. M. Pearce

Michigan Tech Publications

Previous published methods for non-targeted screening of toxins in alternative foods such as leaf concentrate, agricultural residues or plastic fed to biological consortia are time consuming and expensive and thus present accessibility, as well as, time-constraint issues for scientists from under resourced settings to identify safe alternative foods. The novel methodology presented here, utilizes a completely free and open source software toolchain for automatically screening unknown alternative foods for toxicity using experimental data from ultra-high-pressure liquid chromatography and mass spectrometry. The process uses three distinct tools (mass spectrometry analysis with MZmine 2, formula assignment with MFAssignR, and data filtering with …


Preliminary Automated Determination Of Edibility Of Alternative Foods: Non-Targeted Screening For Toxins In Red Maple Leaf Concentrate, Joshua M. Pearce, Maryam Khaksari, David C. Denkenberger Apr 2019

Preliminary Automated Determination Of Edibility Of Alternative Foods: Non-Targeted Screening For Toxins In Red Maple Leaf Concentrate, Joshua M. Pearce, Maryam Khaksari, David C. Denkenberger

Michigan Tech Publications

Alternative food supplies could maintain humanity despite sun-blocking global catastrophic risks (GCRs) that eliminate conventional agriculture. A promising alternative food is making leaf concentrate. However, the edibility of tree leaves is largely uncertain. To overcome this challenge, this study provides the methods for obtaining rapid toxics screening of common leaf concentrates. The investigation begins with a non-targeted approach using an ultra-high-resolution hybrid ion trap orbitrap mass spectrometer with electrospray ionization (ESI) coupled to an ultra-high pressure two-dimensional liquid chromatograph system on the most common North American leaf: the red maple. Identified chemicals from this non-targeted approach are then cross-referenced with …