Metabolomics studies have identified small molecules that mediate cell signaling, competition and disease pathology, in part due to large-scale community efforts to measure tandem mass spectra for ...

Predicting target formulas directly from MS/MS spectra under varying experimental conditions presents significant challenges. To address this, we break down the task into three steps as illustrated in ...

In chemistry, the chemical nomenclature of ionic and molecular compounds uses a systematic approach of prefixes to indicate the number of each element present in the compound. This chemical naming of ...