Jiahua Deng

Publication Activity (10 Years)

Years Active: 2020-2024
Publications (10 Years): 25

Top Topics

Molecular Dynamics Simulations

Density Functional Theory

Crystal Structure

Top Venues

Journal of the American Chemical Society

The journal of physical chemistry letters

Journal of chemical theory and computation

This page only lists publications with an associated author ORCID identifier.

Publications

Ivan Corbeski, Pablo Andrés Vargas-Rosales, Rajiv Kumar Bedi, Jiahua Deng, Dylan Coelho, Emmanuelle Braud, Laura Iannazzo, Yaozong Li, Danzhi Huang, Mélanie Ethève-Quelquejeu, Qiang Cui, Amedeo Caflisch
The catalytic mechanism of the RNA methyltransferase METTL3. eLife 12 (2024)
Jiahua Deng, Yuchen Yuan, Qiang Cui
Modulation of Allostery with Multiple Mechanisms by Hotspot Mutations in TetR. Journal of the American Chemical Society 146 (4) (2024)
Jiahua Deng, Qiang Cui
Electronic Polarization Leads to a Drier Dewetted State for Hydrophobic Gating in the Big Potassium Channel. The journal of physical chemistry letters 15 (29) (2024)
Jiahua Deng, Yuchen Yuan, Qiang Cui
Modulation of Allostery with Multiple Mechanisms by Hotspot Mutations in TetR. Journal of the American Chemical Society 146 (4) (2024)
Jiahua Deng, Qiang Cui
Efficient Sampling of Cavity Hydration in Proteins with Nonequilibrium Grand Canonical Monte Carlo and Polarizable Force Fields. Journal of chemical theory and computation 20 (5) (2024)
Jiahua Deng, Qiang Cui
Electronic Polarization Leads to a Drier Dewetted State for Hydrophobic Gating in the Big Potassium Channel. The journal of physical chemistry letters (2024)
Jiahua Deng, Qiang Cui
Efficient Sampling of Cavity Hydration in Proteins with Nonequilibrium Grand Canonical Monte Carlo and Polarizable Force Fields. Journal of chemical theory and computation 20 (5) (2024)
Jiahua Deng, Qiang Cui
Electronic Polarization Leads to a Drier Dewetted State for Hydrophobic Gating in the Big Potassium Channel. The journal of physical chemistry letters 15 (29) (2024)
Ivan Corbeski, Pablo Andrés Vargas-Rosales, Rajiv Kumar Bedi, Jiahua Deng, Dylan Coelho, Emmanuelle Braud, Laura Iannazzo, Yaozong Li, Danzhi Huang, Mélanie Ethève-Quelquejeu, Qiang Cui, Amedeo Caflisch
The catalytic mechanism of the RNA methyltransferase METTL3. eLife 12 (2024)
Jiahua Deng, Yuchen Yuan, Qiang Cui
Modulation of Allostery with Multiple Mechanisms by Hotspot Mutations in TetR. Journal of the American Chemical Society 146 (4) (2024)
Jiahua Deng, Yuchen Yuan, Qiang Cui
Modulation of Allostery with Multiple Mechanisms by Hotspot Mutations in TetR. Journal of the American Chemical Society 146 (4) (2024)
Jiahua Deng, Yuchen Yuan, Qiang Cui
Modulation of Allostery with Multiple Mechanisms by Hotspot Mutations in TetR. Journal of the American Chemical Society (2024)
Jiahua Deng, Yuchen Yuan, Qiang Cui
Modulation of Allostery with Multiple Mechanisms by Hotspot Mutations in TetR. Journal of the American Chemical Society (2024)
Jiahua Deng, Qiang Cui
Efficient Sampling of Cavity Hydration in Proteins with Nonequilibrium Grand Canonical Monte Carlo and Polarizable Force Fields. Journal of chemical theory and computation (2024)
Jiahua Deng, Qiang Cui
Electronic Polarization Leads to a Drier Dewetted State for Hydrophobic Gating in the Big Potassium Channel. The journal of physical chemistry letters 15 (29) (2024)
Jiahua Deng, Yuchen Yuan, Qiang Cui
Modulation of Allostery with Multiple Mechanisms by Hotspot Mutations in TetR. Journal of the American Chemical Society 146 (4) (2024)
Ivan Corbeski, Pablo Andrés Vargas-Rosales, Rajiv Kumar Bedi, Jiahua Deng, Dylan Coelho, Emmanuelle Braud, Laura Iannazzo, Yaozong Li, Danzhi Huang, Mélanie Ethève-Quelquejeu, Qiang Cui, Amedeo Caflisch
The catalytic mechanism of the RNA methyltransferase METTL3. eLife 12 (2024)
Jiahua Deng, Yuchen Yuan, Qiang Cui
Modulation of Allostery with Multiple Mechanisms by Hotspot Mutations in TetR. bioRxiv : the preprint server for biology (2023)
Ivan Corbeski, Pablo Andrés Vargas-Rosales, Rajiv Kumar Bedi, Jiahua Deng, Dylan Coelho, Emmanuelle Braud, Laura Iannazzo, Yaozong Li, Danzhi Huang, Mélanie Ethève-Quelquejeu, Qiang Cui, Amedeo Caflisch
The catalytic mechanism of the RNA methyltransferase METTL3. bioRxiv : the preprint server for biology (2023)
Jiahua Deng, Qiang Cui
Second-Shell Residues Contribute to Catalysis by Predominately Preorganizing the Apo State in PafA. Journal of the American Chemical Society (2023)
Yuchen Yuan, Jiahua Deng, Qiang Cui
Molecular Dynamics Simulations Establish the Molecular Basis for the Broad Allostery Hotspot Distributions in the Tetracycline Repressor. Journal of the American Chemical Society 144 (24) (2022)
Jiahua Deng, Qiang Cui
Electronic Polarization Is Essential for the Stabilization and Dynamics of Buried Ion Pairs in Staphylococcal Nuclease Mutants. Journal of the American Chemical Society 144 (10) (2022)
Jiahua Deng, Qiang Cui
Reverse Protonation of Buried Ion-Pairs in Staphylococcal Nuclease Mutants. Journal of chemical theory and computation 17 (7) (2021)
Hongbo Chen, Jiahua Deng, Qiang Cui, Baron Chanda, Katherine A Henzler-Wildman
Mapping temperature-dependent conformational change in the voltage-sensing domain of an engineered heat-activated K+ channel. Proceedings of the National Academy of Sciences of the United States of America 118 (14) (2021)
Bo Zhi, Xiaoxiao Yao, Meng Wu, Arielle Mensch, Yi Cui, Jiahua Deng, Juan J Duchimaza-Heredia, Kasidet Jing Trerayapiwat, Thomas Niehaus, Yoshio Nishimoto, Benjamin P Frank, Yongqian Zhang, Riley E Lewis, Elaine A Kappel, Robert John Hamers, D Howard Fairbrother, Galya Orr, Catherine Jones Murphy, Qiang Cui, Christy L Haynes
Multicolor polymeric carbon dots: synthesis, separation and polyamide-supported molecular fluorescence. Chemical science 12 (7) (2020)