Advanced multidimensional separations in mass spectrometry: navigating the big data deluge

JC May, JA McLean - Annual review of analytical chemistry, 2016 - annualreviews.org
Hybrid analytical instrumentation constructed around mass spectrometry (MS) is becoming
the preferred technique for addressing many grand challenges in science and medicine …

Engaging challenges in glycoproteomics: recent advances in MS-based glycopeptide analysis

V Kolli, KN Schumacher, ED Dodds - Bioanalysis, 2015 - Taylor & Francis
The proteomic analysis of glycosylation is uniquely challenging. The numerous and varied
biological roles of protein-linked glycans have fueled a tremendous demand for …

Noise Filtering Algorithm Using Gaussian Mixture Models for High-Resolution Mass Spectra of Natural Organic Matter

AA Potemkin, MA Proskurnin, DS Volkov - Analytical Chemistry, 2024 - ACS Publications
High-resolution mass spectra of natural organic matter (NOM) contain a large number of
noise signals. These signals interfere with the correct molecular composition estimation …

[HTML][HTML] Simplifying MS1 and MS2 spectra to achieve lower mass error, more dynamic range, and higher peptide identification confidence on the Bruker timsTOF Pro

D Wilding-McBride, LF Dagley, SK Spall, G Infusini… - Plos one, 2022 - journals.plos.org
For bottom-up proteomic analysis, the goal of analytical pipelines that process the raw
output of mass spectrometers is to detect, characterise, identify, and quantify peptides. The …

Using SEQUEST with theoretically complete sequence databases

RG Sadygov - Journal of the American Society for Mass …, 2015 - ACS Publications
SEQUEST has long been used to identify peptides/proteins from their tandem mass spectra
and protein sequence databases. The algorithm has proven to be hugely successful for its …

[HTML][HTML] Towards automated discrimination of lipids versus peptides from full scan mass spectra

P Dittwald, TN Vu, GA Harris, RM Caprioli… - EuPA open …, 2014 - Elsevier
Although physicochemical fractionation techniques play a crucial role in the analysis of
complex mixtures, they are not necessarily the best solution to separate specific molecular …

Use of singular value decomposition analysis to differentiate phosphorylated precursors in strong cation exchange fractions

RG Sadygov - Electrophoresis, 2014 - Wiley Online Library
We studied the use of peak deviations (PDs) for application in phosphoproteomics. Due to
the differences in the mass defects, the PDs of samples containing mixtures of …

[HTML][HTML] A flexible statistical model for alignment of label-free proteomics data-incorporating ion mobility and product ion information

AM Benjamin, JW Thompson, EJ Soderblom… - BMC …, 2013 - Springer
Background The goal of many proteomics experiments is to determine the abundance of
proteins in biological samples, and the variation thereof in various physiological conditions …

Application of the half decimal place rule to increase the peptide identification rate

CJ Koehler, RC Bollineni… - Rapid Communications in …, 2017 - Wiley Online Library
Rationale Many MS2 spectra in bottom‐up proteomics experiments remain unassigned. To
improve proteome coverage, we applied the half decimal place rule (HDPR) to remove non …

Use of theoretical Peptide distributions in phosphoproteome analysis

M Kalita, T Kasumov, AR Brasier… - Journal of proteome …, 2013 - ACS Publications
The high mass accuracy and resolution of modern mass spectrometers provides new
opportunities to employ theoretical peptide distributions in large-scale proteomic studies. We …