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Search Publications by: Lewis Geer (Fed)

Displaying 1 - 3 of 3

AIRI: Predicting Retention Indices and Their Uncertainties Using Artificial Intelligence

January 17, 2024

Author(s)

Lewis Geer, Stephen E. Stein, Gary Mallard, Douglas Slotta

The Kováts retention index (RI) is a quantity measured using gas chromatography and is commonly used in the identification of chemical structures. Creating libraries of observed RI values is a laborious task, so we explore the use of a deep neural network

AIomics: Exploring More of the Proteome Using Mass Spectral Libraries Extended by Artificial Intelligence

May 26, 2023

Author(s)

Lewis Geer, Joel Lapin, Douglas Slotta, Tytus Mak, Stephen E. Stein

The unbounded permutations of biological molecules, including proteins and their constituent peptides, present a dilemma in identifying the components of complex biosamples. Sequence search algorithms used to identify peptide spectra can be expanded to