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Recommendations for reporting ion mobility Mass Spectrometry measurements
Here we present a guide to ion mobility mass spectrometry experiments, which covers both linear and nonlinear methods: what is measured, how the measurements are done, and how to report the results, including the uncertainties of mobility and collision cross section values. The guide aims to clarify...
Autores principales: | , , , , , , , , , , , , , , , , , , , , , , , , , , , , , , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
John Wiley and Sons Inc.
2019
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6618043/ https://www.ncbi.nlm.nih.gov/pubmed/30707468 http://dx.doi.org/10.1002/mas.21585 |
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author | Gabelica, Valérie Shvartsburg, Alexandre A. Afonso, Carlos Barran, Perdita Benesch, Justin L.P. Bleiholder, Christian Bowers, Michael T. Bilbao, Aivett Bush, Matthew F. Campbell, J. Larry Campuzano, Iain D.G. Causon, Tim Clowers, Brian H. Creaser, Colin S. De Pauw, Edwin Far, Johann Fernandez‐Lima, Francisco Fjeldsted, John C. Giles, Kevin Groessl, Michael Hogan, Christopher J. Hann, Stephan Kim, Hugh I. Kurulugama, Ruwan T. May, Jody C. McLean, John A. Pagel, Kevin Richardson, Keith Ridgeway, Mark E. Rosu, Frédéric Sobott, Frank Thalassinos, Konstantinos Valentine, Stephen J. Wyttenbach, Thomas |
author_facet | Gabelica, Valérie Shvartsburg, Alexandre A. Afonso, Carlos Barran, Perdita Benesch, Justin L.P. Bleiholder, Christian Bowers, Michael T. Bilbao, Aivett Bush, Matthew F. Campbell, J. Larry Campuzano, Iain D.G. Causon, Tim Clowers, Brian H. Creaser, Colin S. De Pauw, Edwin Far, Johann Fernandez‐Lima, Francisco Fjeldsted, John C. Giles, Kevin Groessl, Michael Hogan, Christopher J. Hann, Stephan Kim, Hugh I. Kurulugama, Ruwan T. May, Jody C. McLean, John A. Pagel, Kevin Richardson, Keith Ridgeway, Mark E. Rosu, Frédéric Sobott, Frank Thalassinos, Konstantinos Valentine, Stephen J. Wyttenbach, Thomas |
author_sort | Gabelica, Valérie |
collection | PubMed |
description | Here we present a guide to ion mobility mass spectrometry experiments, which covers both linear and nonlinear methods: what is measured, how the measurements are done, and how to report the results, including the uncertainties of mobility and collision cross section values. The guide aims to clarify some possibly confusing concepts, and the reporting recommendations should help researchers, authors and reviewers to contribute comprehensive reports, so that the ion mobility data can be reused more confidently. Starting from the concept of the definition of the measurand, we emphasize that (i) mobility values (K (0)) depend intrinsically on ion structure, the nature of the bath gas, temperature, and E/N; (ii) ion mobility does not measure molecular surfaces directly, but collision cross section (CCS) values are derived from mobility values using a physical model; (iii) methods relying on calibration are empirical (and thus may provide method‐dependent results) only if the gas nature, temperature or E/N cannot match those of the primary method. Our analysis highlights the urgency of a community effort toward establishing primary standards and reference materials for ion mobility, and provides recommendations to do so. © 2019 The Authors. Mass Spectrometry Reviews Published by Wiley Periodicals, Inc. |
format | Online Article Text |
id | pubmed-6618043 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2019 |
publisher | John Wiley and Sons Inc. |
record_format | MEDLINE/PubMed |
spelling | pubmed-66180432019-07-22 Recommendations for reporting ion mobility Mass Spectrometry measurements Gabelica, Valérie Shvartsburg, Alexandre A. Afonso, Carlos Barran, Perdita Benesch, Justin L.P. Bleiholder, Christian Bowers, Michael T. Bilbao, Aivett Bush, Matthew F. Campbell, J. Larry Campuzano, Iain D.G. Causon, Tim Clowers, Brian H. Creaser, Colin S. De Pauw, Edwin Far, Johann Fernandez‐Lima, Francisco Fjeldsted, John C. Giles, Kevin Groessl, Michael Hogan, Christopher J. Hann, Stephan Kim, Hugh I. Kurulugama, Ruwan T. May, Jody C. McLean, John A. Pagel, Kevin Richardson, Keith Ridgeway, Mark E. Rosu, Frédéric Sobott, Frank Thalassinos, Konstantinos Valentine, Stephen J. Wyttenbach, Thomas Mass Spectrom Rev Review Articles Here we present a guide to ion mobility mass spectrometry experiments, which covers both linear and nonlinear methods: what is measured, how the measurements are done, and how to report the results, including the uncertainties of mobility and collision cross section values. The guide aims to clarify some possibly confusing concepts, and the reporting recommendations should help researchers, authors and reviewers to contribute comprehensive reports, so that the ion mobility data can be reused more confidently. Starting from the concept of the definition of the measurand, we emphasize that (i) mobility values (K (0)) depend intrinsically on ion structure, the nature of the bath gas, temperature, and E/N; (ii) ion mobility does not measure molecular surfaces directly, but collision cross section (CCS) values are derived from mobility values using a physical model; (iii) methods relying on calibration are empirical (and thus may provide method‐dependent results) only if the gas nature, temperature or E/N cannot match those of the primary method. Our analysis highlights the urgency of a community effort toward establishing primary standards and reference materials for ion mobility, and provides recommendations to do so. © 2019 The Authors. Mass Spectrometry Reviews Published by Wiley Periodicals, Inc. John Wiley and Sons Inc. 2019-02-01 2019 /pmc/articles/PMC6618043/ /pubmed/30707468 http://dx.doi.org/10.1002/mas.21585 Text en © 2019 The Authors. Mass Spectrometry Reviews Published by Wiley Periodicals, Inc. This is an open access article under the terms of the http://creativecommons.org/licenses/by/4.0/ License, which permits use, distribution and reproduction in any medium, provided the original work is properly cited. |
spellingShingle | Review Articles Gabelica, Valérie Shvartsburg, Alexandre A. Afonso, Carlos Barran, Perdita Benesch, Justin L.P. Bleiholder, Christian Bowers, Michael T. Bilbao, Aivett Bush, Matthew F. Campbell, J. Larry Campuzano, Iain D.G. Causon, Tim Clowers, Brian H. Creaser, Colin S. De Pauw, Edwin Far, Johann Fernandez‐Lima, Francisco Fjeldsted, John C. Giles, Kevin Groessl, Michael Hogan, Christopher J. Hann, Stephan Kim, Hugh I. Kurulugama, Ruwan T. May, Jody C. McLean, John A. Pagel, Kevin Richardson, Keith Ridgeway, Mark E. Rosu, Frédéric Sobott, Frank Thalassinos, Konstantinos Valentine, Stephen J. Wyttenbach, Thomas Recommendations for reporting ion mobility Mass Spectrometry measurements |
title | Recommendations for reporting ion mobility Mass Spectrometry measurements |
title_full | Recommendations for reporting ion mobility Mass Spectrometry measurements |
title_fullStr | Recommendations for reporting ion mobility Mass Spectrometry measurements |
title_full_unstemmed | Recommendations for reporting ion mobility Mass Spectrometry measurements |
title_short | Recommendations for reporting ion mobility Mass Spectrometry measurements |
title_sort | recommendations for reporting ion mobility mass spectrometry measurements |
topic | Review Articles |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6618043/ https://www.ncbi.nlm.nih.gov/pubmed/30707468 http://dx.doi.org/10.1002/mas.21585 |
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