Automated Annotation with SIRIUS 6
We had an incredible turnout, with over 80 interested (future) SIRIUS users filling the room.
We demonstrated how SIRIUS 6 is transforming small molecule annotation by going beyond traditional spectral libraries. By combining structural database searching and molecular structure generation, SIRIUS 6 offers a powerful, integrated approach to annotation. We also highlighted the seamless integration of spectral libraries for robust validation through analog searching.
It was inspiring to see such strong interest in advanced metabolomics tools. We wrapped up with a vibrant 20-minute Q&A.
Thanks to everyone who joined and engaged so actively!
Workshop Recap
The easy way to comprehensive structure elucidation
SIRIUS is the comprehensive software solution for the high-throughput identification of small molecules from fragmentation mass spectrometry data. SIRIUS provides a comprehensive set of features spanning every step from feature detection to detailed result validation. It is designed to not only accurately characterize known compounds but also to confidently identify “unknown unknowns” in complex biological samples.
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