Vincent A. Voelz

Molecular Simulation of <i>ab Initio</i> Protein Folding for a Millisecond Folder NTL9(1−39)

Vincent A. Voelz, Gregory R. Bowman, Kyle A. Beauchamp et al. · Journal of the American Chemical Society · 2010 · 511 citations

SARS-CoV-2 simulations go exascale to predict dramatic spike opening and cryptic pockets across the proteome

Maxwell I. Zimmerman, Justin R. Porter, Michael D. Ward et al. · Nature Chemistry · 2021 · 288 citations · Full text

Markov State Model Reveals Folding and Functional Dynamics in Ultra-Long MD Trajectories

Thomas J. Lane, Gregory R. Bowman, Kyle A. Beauchamp et al. · Journal of the American Chemical Society · 2011 · 174 citations · Full text

Biophysical Modeling, Engineering, Structural Bioinformatics +22

Open science discovery of potent noncovalent SARS-CoV-2 main protease inhibitors

Melissa L. Boby, D. Fearon, Matteo P. Ferla et al. · Science · 2023 · 158 citations · Full text

Slow Unfolded-State Structuring in Acyl-CoA Binding Protein Folding Revealed by Simulation and Experiment

Vincent A. Voelz, Markus Jäger, Shuhuai Yao et al. · Journal of the American Chemical Society · 2012 · 146 citations · Full text

Protein Assembly, Molecular Biology, Analytical Ultracentrifugation +19