MAGMA provides exact assignments of NMR methyl-TROSY spectra by comparing the experimental signal with a representative protein atomic structure. To do so, it leverages an algorithm based on graph theory yielding, for each peak, an exhaustive list of all possible assignments.
MAGMA has been designed with Iva Pritisanac (Baldwin group, University of Oxford).
MAGMA is available for download here.
- I. Pritisanac, M. T. Degiacomi, T. R. Alderson, M. G. Carneiro, E. AB, G. Siegal, A .J. Baldwin (2017). Automatic Assignment of Methyl-NMR Spectra of Supramolecular Machines Using Graph Theory, JACS, 2017
- European patent: WO2017199030, 2018.
- US patent: 20200124689, 2019