Publications

This partial list of Bleiholder Group publications (2005 - present) includes links to the articles on the publishers' web sites.

2017

F. Liu, M. Ridgeway, M. Park, C. Bleiholder:
Two-dimensional, time-resolved trapped ion mobility spectrometry-mass spectrometry (TIMS/TIMS-MS) to study conformations of peptides and proteins.
254th American Chemical Society National Meeting & Exposition, Washington, D.C., August 2017.

C. Bleiholder:
Structure-elucidation from ion mobility spectrometry-mass spectrometry data: are detailed structures amenable?
Advancing Mass Spectrometry for Biophysics and Structural Biology Meeting, Ann Arbor, MI, July 2017.

C. Bleiholder:
De novo Elucidation of Protein Structures with Ion Mobility Spectrometry / Mass Spectrometry
65TH ASMS Conference on Mass Spectrometry and Allied Topics, Indianapolis, IN, June 2017.

F. C. Liu, M. Ridgeway, M. Park, C. Bleiholder:
Multidimensional, Time-resolved Trapped Ion Mobility Spectrometry-Mass Spectrometry (TIMS/TIMS-MS) to Elucidate Conformations of Proteins
65TH ASMS Conference on Mass Spectrometry and Allied Topics, Indianapolis, IN, June 2017.

S. R. Kirk, F. C. Liu, M. Ridgeway, M. Park, C. Bleiholder:
Trapped ion mobility spectrometry enables time-resolved ion mobility measurements upwards of 15 seconds under essentially thermal conditions.
submitted.

C. Bleiholder, M. T. Bower:
The Solution Assembly of Biological Molecules Using Ion Mobility Methods: From Amino Acids to Amyloid β-Protein.
Annual Review of Analytical Chemistry 10(1), 365-386 (2017).

M. N. Young, C. Bleiholder:
Molecular Structures and Momentum Transfer Cross Sections: The Influence of the Analyte Charge Distribution.
Journal of The American Society for Mass Spectrometry 28(4), 619-627 (2017).

C. Bleiholder, N. F. Dupuis, M. Murray Gessel and M. T. Bowers:
Structural effects of chirally mutated Enkephalin neurotransmitters: an argument for biological homochirality.
International Journal of Mass Spectrometry 413, 52-60 (2017).

2016

F. C. Liu, S. R. Kirk, C. Bleiholder:
On the Structural Denaturation of Biological Analytes in Trapped Ion Mobility Spectrometry - Mass Spectrometry.
Analyst 141, 3722 – 3730 (2016).

C. Bleiholder:
Towards measuring ion mobilities in non-stationary gases and non-uniform and dynamic electric fields.
International Journal of Mass Spectrometry 399–400, 1–9 (2016).

2015

C. Bleiholder:
A local collision probability approximation for predicting momentum transfer cross sections.
Analyst 14, 6804-6813 (2015).

T. Wyttenbach, C. Bleiholder, S. E. Anderson, M. T. Bowers:
A new algorithm to characterise the degree of concaveness of a molecular surface relevant in ion mobility spectrometry.
Molecular Physics 113, 2344-2349 (2015).

C. Bleiholder, N. R. Johnson, S. Contreras, T. Wyttenbach, M. T. Bowers:
Molecular Structures and Ion Mobility Cross Sections: Analysis of the Effects of He and N2 Buffer Gas.
Analytical Chemistry 87, 7196-7203 (2015).

S. Warnke, J. Seo, J. Boschmans, F. Sobott, J. H. Scrivens, C. Bleiholder, M. T. Bowers, S. Gewinner, W. Schöllkopf, K. Pagel, G. v. Helden:
Protomers of Benzocaine: Solvent and Permittivity Dependence.
Journal of the American Chemical Society 137, 4236-4242 (2015).

2013

C. Bleiholder, T. D. Do, C. Wu, N. J. Economou, S. S. Bernstein, S. K. Buratto, J. Shea, and M. T. Bowers:
Ion Mobility Spectrometry Reveals the Mechanism of Amyloid Formation of Aβ(25-35) and its Modulation by Inhibitors at the Molecular Level: Epigallocatechin Gallate and Scyllo-Inositol.
Journal of the American Chemical Society 135, 16926–16937 (2013).

T. D. Do, N. J. Economou, N. E. LaPointe, W. M. Kincannon, C. Bleiholder, S. C. Feinstein, D. B. Teplow, S. K. Buratto, M. T.Bowers:
Factors that drive peptide assembly and fibril formation: Experimental and theoretical analysis of Sup35 NNQQNY mutants.
Journal of Physical Chemistry B 117, 8436-8446 (2013).

C. Bleiholder, S. Contreras, M. T. Bowers:
A novel projection approximation algorithm for the fast and accurate computation of molecular collision cross sections (IV). Application to polypeptides.
International Journal of Mass Spectrometry 354–355, 275–280 (2013).

Y. Seo, A. Andaya, C. Bleiholder, M. T. Bowers, J. A. Leary:
Differentiation of CC vs CXC chemokine dimers with GAG octasaccharide binding partners: An ion mobility mass spectrometry approach.
Journal of the American Chemical Society, 135, 4325-4332 (2013).

C. Bleiholder, N. F. Dupuis, M. Murray Gessel, M. T. Bowers:
Dimerization of chirally mutated Enkephalin neurotransmitters: implications for peptide and protein aggregation mechanisms.
Journal of Physical Chemistry B 117, 1770-1779 (2013).

T. Wyttenbach, C. Bleiholder, M. T. Bowers:
Factors contributing to the collision cross section of molecular ions in the kilodalton to gigadolton range.
Analytical Chemstry 85, 2191−2199 (2013).

C. Bleiholder, S. Contreras, T. D. Do, M. T. Bowers:
A novel projection approximation algorithm for the fast and accurate computation of molecular collision cross sections(II). Model parameterization and definition of empirical shape factors for proteins.
International Journal of Mass Spectrometry 345-347, 89– 96 (2013).

2011-2012

S. E. Anderson, C. Bleiholder, E. R. Brocker, P. J. Stang, M. T. Bowers:
A novel projection approximation algorithm for the fast and accurate computation of molecular collision cross sections (III). Application to Supramolecular Coordination-Driven Assemblies.
International Journal of Mass Spectrometry 330–332, 78-84 (2012).

C. Bleiholder, T. Wyttenbach, M. T. Bowers:
A novel projection approximation algorithm for the fast and accurate computation of molecular collision cross sections (I). Method.
International Journal of Mass Spectrometry 308, 1-10 (2011).

C. Bleiholder, S. Suhai, A. G. Harrison, B. Paizs:
Towards understanding the tandem mass spectra of protonated oligopeptides. 2: The proline effect in collision-induced dissociation of protonated Ala-Ala-Xxx-Pro-Ala (Xxx =Ala, Ser, Leu, Val, Phe, and Trp).
Journal of the American Society for Mass Spectrometry 22, 1032-1039 (2011).

C. Bleiholder, N. F. Dupuis, T. Wyttenbach, M. T. Bowers:
Ion mobility–mass spectrometry reveals a conformational conversion from random assembly to Beta-sheet in amyloid fibril formation.
Nature Chemistry 3, 172-177 (2011).

2008-2010

C. Bleiholder, B. Paizs:
Competing gas-phase fragmentation pathways of asparagine-, glutamine-, and lysine- containing protonated dipeptides.
Theoretical Chemistry Accounts 125, 387-396 (2010).

A. Lari, C. Bleiholder, F. Rominger, R. Gleiter:
Intramolecular nonbonded interactions between divalent selenium centers with donor and acceptor substituents.
European Journal of Organic Chemistry 17, 2765-2774 (2009).

C. Bleiholder, F. Rominger, R. Gleiter:
Alpha-Metallocenylmethylium ions and their isoelectronic congeners ­ a comparison based on DFT calculations.
Organometallics 28, 1014-1017 (2009).

C. Bleiholder, S. Osburn, T. Williams, S. Suhai, M. Van Stipdonk, A. Harrison, B. Paizs:
Sequence scrambling fragmentation pathways of protonated peptides.
Journal of the American Chemical Society 130, 17774–17789 (2008).

2007

R. Gleiter, C. Bleiholder, F. Rominger:
Alpha-Metallocenylmethylium ions of d6 to d9 metals. Structural considerations.
Organometallics 26, 4850-4859 (2007).

F. Pingitore, C. Bleiholder, B. Paizs, C. Wesdemiotis:
Unimolecular chemistry of metal ion-coordinated Alpha-dipeptide radicals.
International Journal of Mass Spectrometry 265, 251-260 (2007).

C. Bleiholder, R. Gleiter, D. B. Werz, H. Köppel:
Theoretical investigations on heteronuclear chalcogen-chalcogen interactions: On the nature of weak bonds between chalcogen centers.
Inorganic Chemistry 46, 2249-2260 (2007).

S. Gath, R. Gleiter, F. Rominger, C. Bleiholder:
Transannular interactions in mixed superphanes with one thiophene and one CpCo-stabilized cyclobutadiene ring: Syntheses, structures, and electrochemistry.
Organometallics 26, 644–6 (2007).

2005-2006

A. G. Harrison, A. B. Young, C. Bleiholder, S. Suhai, B. Paizs:
Scrambling of sequence information in collision-induced dissociation of peptides.
Journal of the American Chemical Society 128, 10364-10365 (2006).

D. B. Werz, C. Bleiholder, R. Gleiter, F. Rominger:
Strong distortions in hexacarbonyldicobalt complexes by push-pull effects.
Journal of Organometallic Chemistry 691, 3943-3947 (2006).

C. Bleiholder, S. Suhai, B. Paizs:
Revising the proton affinity scale of the naturally occuring Alpha-amino acids.
Journal of the American Society for Mass Spectrometry 17, 1275-1281 (2006).

P. Wang, M. J. Polce, C. Bleiholder, B. Paizs, C. Wesdemiotis:
Structural characterization of peptides via tandem mass spectrometry of their dilithiated monocations.
International Journal of Mass Spectrometry 249, 45-59 (2006).

C. Bleiholder, D. B. Werz, H. Köppel, R. Gleiter:
Theoretical investigations on chalcogen-chalcogen-interactions: What makes these nonbonded interactions bonding?
Journal of the American Chemical Society 128, 2666-2674 (2006).

C. Bleiholder, H. Borzel, P. Comba, R. Ferrari, M. Heydt, M. Kerscher, S. Kuwata, G. Laurenczy, G. A. Lawrance, A. Lienke, B. Martin, M. Merz, B. Nuber, H. Pritzkow:
Coordination chemistry of a new rigid, hexadentate bispidine-based bis(amine)tetrakis (pyridine) ligand.
Inorganic Chemistry 44, 8145-8155 (2005).