Hierarchical clustering of liquid chromatography-tandem mass spectrometry data for screening of phosphodiesterase type 5 inhibitors and their analogues in adulterated dietary supplements

MS-DIAL: data-independent MS/MS deconvolution for comprehensive metabolome analysis

Hiroshi Tsugawa, Tomáš Čajka, Tobias Kind et al. · Nature Methods · 2015 · 3.4K citations · Full text

Life Sciences, Biochemistry, Mass Spectrometric Analysis +13

Rapid Prediction of Electron–Ionization Mass Spectrometry Using Neural Networks

Jennifer N. Wei, David Belanger, Ryan P. Adams et al. · ACS Central Science · 2019 · 196 citations · Full text

Natural Sciences, Bioinformatics, Chemistry +14

Simultaneous determination of synthetic phosphodiesterase-5 inhibitors found in a dietary supplement and pre-mixed bulk powders for dietary supplements using high-performance liquid chromatography with diode array detection and liquid chromatography–electrospray ionization tandem mass spectrometry

Peng Zou, Sharon Sze‐Yin Oh, Peiling Hou et al. · Journal of Chromatography A · 2005 · 148 citations

Natural Sciences, Pharmaceutical Analysis, Pharmacology +16

Phylogenetic Classification of <i>Pseudomonas </i><i>putida</i> Strains by MALDI-MS Using Ribosomal Subunit Proteins as Biomarkers

Kanae Teramoto, Hiroaki Sato, Liwei Sun et al. · Analytical Chemistry · 2007 · 108 citations

Life Sciences, Bioinformatics, Microbiology +17

Accurate mass measurement using Fourier transform ion cyclotron resonance mass spectrometry for structure elucidation of designer drug analogs of tadalafil, vardenafil and sildenafil in herbal and pharmaceutical matrices

Samuel R. Gratz, Bryan M. Gamble, Rick A. Flurer · Rapid Communications in Mass Spectrometry · 2006 · 94 citations · Full text

Pharmacy, Medicinal Chemistry, Pharmacology +16