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Structure (London, England : 1993)|March 8, 2018
Mechanism of Mg<sup>2+</sup>-Accompanied Product Release in Sugar NucleotidyltransferasesNeha Vithani, Pravin Kumar Ankush Jagtap, Sunil Kumar Verma, et al.The Journal of Biological Chemistry|September 13, 2012
Substrate-bound crystal structures reveal features unique to Mycobacterium tuberculosis N-acetyl-glucosamine 1-phosphate uridyltransferase and a catalytic mechanism for acetyl transferPravin Kumar Ankush Jagtap, Vijay Soni, Neha Vithani, et al.Biorxiv : the Preprint Server for Biology|December 17, 2020
SARS-CoV-2 Nsp16 activation mechanism and a cryptic pocket with pan-coronavirus antiviral potentialNeha Vithani, Michael D Ward, Maxwell I Zimmerman, et al.Biophysical Journal|April 1, 2021
SARS-CoV-2 Nsp16 activation mechanism and a cryptic pocket with pan-coronavirus antiviral potentialNeha Vithani, Michael D Ward, Maxwell I Zimmerman, et al.Nature Communications|April 28, 2022
A cryptic pocket in Ebola VP35 allosterically controls RNA bindingMatthew A Cruz, Thomas E Frederick, Upasana L Mallimadugula, et al.Journal of Chemical Information and Modeling|October 17, 2024
Exploration of Cryptic Pockets Using Enhanced Sampling Along Normal Modes: A Case Study of KRAS <sup>G12D</sup>Neha Vithani, She Zhang, Jeffrey P Thompson, et al.Biorxiv : the Preprint Server for Biology|June 27, 2020
The SARS-CoV-2 nucleocapsid protein is dynamic, disordered, and phase separates with RNAJasmine Cubuk, Jhullian J Alston, J Jeremías Incicco, et al.Nature Communications|March 30, 2021
The SARS-CoV-2 nucleocapsid protein is dynamic, disordered, and phase separates with RNAJasmine Cubuk, Jhullian J Alston, J Jeremías Incicco, et al.Nature Chemistry|May 25, 2021
SARS-CoV-2 simulations go exascale to predict dramatic spike opening and cryptic pockets across the proteomeMaxwell I Zimmerman, Justin R Porter, Michael D Ward, et al.Biorxiv : the Preprint Server for Biology|July 9, 2020
SARS-CoV-2 Simulations Go Exascale to Capture Spike Opening and Reveal Cryptic Pockets Across the ProteomeMaxwell I Zimmerman, Justin R Porter, Michael D Ward, et al.Pageof 2