ReactionEye: Integrating GC–MS Data and Chemical Context for Multimodal Structure Elucidation in Reaction Screening

Maik Gabriel Niedziella, Philipp Miro Pflüger, Frank Glorius

Submission Type: I want my submission to be considered for both oral and poster presentation.

Keywords: Molecular Machine Learning, Organic Chemistry, High-Throughput Screening, Analytical Chemistry

TL;DR: ReactionEye is a multimodal framework that automates molecular structure elucidation from GC–MS data by jointly interpreting mass spectra and chemical reaction context to enable scalable reaction screening.

Confirmation Of Submission Requirements: I submit an abstract. It uses the template provided on the submission page and is no longer than 2 pages.

Submission Number: 279