Yannek Nowatzky
yanneknowatzky.bsky.social
Yannek Nowatzky
@yanneknowatzky.bsky.social
Our paper on FIORA is now officially published in @naturecomms.bsky.social! 🔓Peer-reviewed and ready to shake up mass spec predictions. ⚗️🔨💻📈

Github: github.com/BAMeScience/...
Paper: www.nature.com/articles/s41...

Many thanks to everyone involved 🙌 #MachineLearning #MassSpec #Metabolomics #FIORA
FIORA: Local neighborhood-based prediction of compound mass spectra from single fragmentation events - Nature Communications
FIORA, an advanced graph neural network, enhances the simulation of tandem mass spectra by learning molecular bond-breaking patterns. The open-source algorithm generates high-quality reference spectra...
www.nature.com
March 11, 2025 at 9:35 AM