MSNovelist: A New Method for Generating Small Molecule Structures from Mass Spectra

MSNovelist: A New Method for Generating Small Molecule Structures from Mass Spectra

Compiled by | Jiang Changzhi Today, I would like to introduce an article published in Nature Methods by a team from ETH Zurich and Friedrich Schiller University Jena. The article proposes a new method for generating small molecule structures from mass spectrometry based on an encoder-decoder neural network: MSNovelist. It first uses SIRIUS and CSI: … Read more