Proteins in the gas phase

Charge-State Dependent Compaction and Dissociation of Protein Complexes: Insights from Ion Mobility and Molecular Dynamics

(2012) Zoe Hall et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Structure of Triplex DNA in the Gas Phase

(2012) Annalisa Arcella et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

How Ubiquitin Unfolds after Transfer into the Gas Phase

(2012) Owen S. Skinner et al.   JOURNAL OF THE AMERICAN SOCIETY FOR MASS SPECTROMETRY

Conformational Distribution of Bradykinin [bk + 2 H]2+ Revealed by Cold Ion Spectroscopy Coupled with FAIMS

(2012) Georgios Papadopoulos et al.   JOURNAL OF THE AMERICAN SOCIETY FOR MASS SPECTROMETRY

Interplay of Intra- and Intermolecular H-Bonding in a Progressively Solvated Macrocyclic Peptide

(2012) N. S. Nagornova et al.   SCIENCE

Determination of Noncovalent Docking by Infrared Spectroscopy of Cold Gas-Phase Complexes

(2012) E. Garand et al.   SCIENCE

Electrospray Ionization Mass Spectrometry: A Technique to Access the Information beyond the Molecular Weight of the Analyte

(2012) Shibdas Banerjee et al.   International Journal of Analytical Chemistry

Effective Temperature of Ions in Traveling Wave Ion Mobility Spectrometry

(2011) Denis Morsa et al.   ANALYTICAL CHEMISTRY

Charge-Surface Correlation in Electrospray Ionization of Folded and Unfolded Proteins

(2011) Lorenzo Testa et al.   ANALYTICAL CHEMISTRY

Advances in the Mass Spectrometry of Membrane Proteins: From Individual Proteins to Intact Complexes

(2011) Nelson P. Barrera et al.   Annual Review of Biochemistry

Expanding the view of proton pumping in cytochrome c oxidase through computer simulation

(2011) Yuxing Peng et al.   BIOCHIMICA ET BIOPHYSICA ACTA-BIOENERGETICS

Protein-nucleic acid complexes and the role of mass spectrometry in their structure determination

(2011) Ah Young Park et al.   CRITICAL REVIEWS IN BIOCHEMISTRY AND MOLECULAR BIOLOGY

Constant pH Molecular Dynamics in Explicit Solvent with λ-Dynamics

(2011) Serena Donnini et al.   Journal of Chemical Theory and Computation

Modeling the Behavior of Coarse-Grained Polymer Chains in Charged Water Droplets: Implications for the Mechanism of Electrospray Ionization

(2011) Elias Ahadi et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Structural Stability from Solution to the Gas Phase: Native Solution Structure of Ubiquitin Survives Analysis in a Solvent-Free Ion Mobility–Mass Spectrometry Environment

(2011) Thomas Wyttenbach et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Ejection of Solvated Ions from Electrosprayed Methanol/Water Nanodroplets Studied by Molecular Dynamics Simulations

(2011) Elias Ahadi et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Number of Solution States of Bradykinin from Ion Mobility and Mass Spectrometry Measurements

(2011) Nicholas A. Pierson et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

How Hot are Your Ions in TWAVE Ion Mobility Spectrometry?

(2011) Samuel I. Merenbloom et al.   JOURNAL OF THE AMERICAN SOCIETY FOR MASS SPECTROMETRY

Supercharging Protein Complexes from Aqueous Solution Disrupts their Native Conformations

(2011) Harry J. Sterling et al.   JOURNAL OF THE AMERICAN SOCIETY FOR MASS SPECTROMETRY

Compelling Evidence for Lucky Survivor and Gas Phase Protonation: The Unified MALDI Analyte Protonation Mechanism

(2011) Thorsten W. Jaskolla et al.   JOURNAL OF THE AMERICAN SOCIETY FOR MASS SPECTROMETRY

Femtosecond X-ray protein nanocrystallography

(2011) Henry N. Chapman et al.   NATURE

The role of conformational flexibility on protein supercharging in native electrospray ionization

(2011) Harry J. Sterling et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Probing electrostatic interactions and structural changes in highly charged protein polyanions by conformer-selective photoelectron spectroscopy

(2011) Matthias Vonderach et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Visible and ultraviolet spectroscopy of gas phase protein ions

(2011) Rodolphe Antoine et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

How useful is ion mobility mass spectrometry for structural biology? The relationship between protein crystal structures and their collision cross sections in the gas phase

(2010) Ewa Jurneczko et al.   ANALYST

Electrostatic Stabilization of a Native Protein Structure in the Gas Phase

(2010) Kathrin Breuker et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Artificial neural networks for the prediction of peptide drift time in ion mobility mass spectrometry

(2010) Bing Wang et al.   BMC BIOINFORMATICS

Top-down mass spectrometry of supercharged native protein–ligand complexes

(2010) Sheng Yin et al.   INTERNATIONAL JOURNAL OF MASS SPECTROMETRY

Molecular Simulation ofab InitioProtein Folding for a Millisecond Folder NTL9(1−39)

(2010) Vincent A. Voelz et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Proteins, Lipids, and Water in the Gas Phase

(2010) David van der Spoel et al.   MACROMOLECULAR BIOSCIENCE

Ribosome dynamics and tRNA movement by time-resolved electron cryomicroscopy

(2010) Niels Fischer et al.   NATURE

Protein folded states are kinetic hubs

(2010) G. R. Bowman et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

Gas Phase Stabilization of Noncovalent Protein Complexes Formed by Electrospray Ionization

(2009) Dhanashri Bagal et al.   ANALYTICAL CHEMISTRY

Encapsulation of Myoglobin in a Cetyl Trimethylammonium Bromide Micelle in Vacuo: A Simulation Study†

(2009) Yaofeng Wang et al.   BIOCHEMISTRY

On the Use of low-resolution Data to Improve Structure Prediction of Proteins and Protein Complexes

(2009) Marco D’Abramo et al.   Journal of Chemical Theory and Computation

Molecular Dynamics Simulations of a Membrane Protein−Micelle Complex in Vacuo

(2009) Rosmarie Friemann et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Infrared multiple photon dissociation spectroscopy of ions in Penning traps

(2009) John R. Eyler   MASS SPECTROMETRY REVIEWS

Vibrational spectroscopy of bare and solvated ionic complexes of biological relevance

(2009) Nick C. Polfer et al.   MASS SPECTROMETRY REVIEWS

Using generalized ensemble simulations and Markov state models to identify conformational states

(2009) Gregory R. Bowman et al.   METHODS

Dehydrated but unharmed

(2009) Justin L. P. Benesch et al.   NATURE

Structural stability of electrosprayed proteins: temperature and hydration effects

(2009) Erik G. Marklund et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Constructing the equilibrium ensemble of folding pathways from short off-equilibrium simulations

(2009) Frank Noé et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

An Atomistic View to the Gas Phase Proteome

(2009) Tim Meyer et al.   STRUCTURE

Combined Charged Residue-Field Emission Model of Macromolecular Electrospray Ionization

(2008) Christopher J. Hogan et al.   ANALYTICAL CHEMISTRY

Nanojets, Electrospray, and Ion Field Evaporation: Molecular Dynamics Simulations and Laboratory Experiments

(2008) W. D. Luedtke et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Micelles Protect Membrane Complexes from Solution to Vacuum

(2008) N. P. Barrera et al.   SCIENCE

MAMMOTH (Matching molecular models obtained from theory): An automated method for model comparison

(2002) Angel R. Ortiz et al.   PROTEIN SCIENCE