%0 Generic %A POPE, BERNARD %A Leeming, Michael %A ISAAC, ANDREW %D 2019 %T HiTIME large test dataset %U https://melbourne.figshare.com/articles/dataset/HiTIME_large_test_dataset/7609970 %R 10.26188/5c451a7ea7874 %2 https://melbourne.figshare.com/ndownloader/files/14131085 %K Twin Ion Mass Spectrometry %K Analytical Biochemistry %K Bioinformatics %K Proteomics and Intermolecular Interactions (excl. Medical Proteomics) %X It's a pure protein that was reduced, reacted with heavy/light paracetamol and then digested. The advantage is that there are lots of twin ions in there. Because these twin-ions are mostly peptide derivatives, they come in multiple charge states which effectively gives us a few different doublet spacings. There are many separated by 6.0201 as before, a good number separated by 3.01005 and a few separated by 2.0067. We have removed any points with intensity <1000 to make the file smaller. %I The University of Melbourne