Qianyi Cheng

Publication Activity (10 Years)

Years Active: 2019-2024
Publications (10 Years): 11

Top Topics

Bacillus Subtilis

Magnetic Resonance

Hydrogen Peroxide

High Temperature

Top Venues

Physical chemistry chemical physics : PCCP

The journal of physical chemistry. B

The Journal of chemical physics

Journal of chemical information and modeling

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

Publications

Donatus A Agbaglo, Thomas J Summers, Qianyi Cheng, Nathan J DeYonker
The influence of model building schemes and molecular dynamics sampling on QM-cluster models: the chorismate mutase case study. Physical chemistry chemical physics : PCCP 26 (16) (2024)
Donatus A Agbaglo, Thomas J Summers, Qianyi Cheng, Nathan J DeYonker
The influence of model building schemes and molecular dynamics sampling on QM-cluster models: the chorismate mutase case study. Physical chemistry chemical physics : PCCP 26 (16) (2024)
Donatus A Agbaglo, Thomas J Summers, Qianyi Cheng, Nathan J DeYonker
The influence of model building schemes and molecular dynamics sampling on QM-cluster models: the chorismate mutase case study. Physical chemistry chemical physics : PCCP 26 (16) (2024)
Donatus A Agbaglo, Thomas J Summers, Qianyi Cheng, Nathan J DeYonker
The influence of model building schemes and molecular dynamics sampling on QM-cluster models: the chorismate mutase case study. Physical chemistry chemical physics : PCCP (2024)
Qianyi Cheng, Nathan J DeYonker
The Glycine N -Methyltransferase Case Study: Another Challenge for QM-Cluster Models? The journal of physical chemistry. B (2023)
Thomas J Summers, Reza Hemmati, Justin E Miller, Donatus A Agbaglo, Qianyi Cheng, Nathan J DeYonker
Evaluating the active site-substrate interplay between x-ray crystal structure and molecular dynamics in chorismate mutase. The Journal of chemical physics 158 (6) (2023)
Donatus A Agbaglo, Qianyi Cheng, Ryan C Fortenberry, John F Stanton, Nathan J DeYonker
Theoretical Rovibrational Spectroscopy of Magnesium Tricarbide-Multireference Character Thwarts a Full Analysis of All Isomers. The journal of physical chemistry. A 126 (26) (2022)
Qianyi Cheng, Nathan J DeYonker
QM-Cluster Model Study of the Guaiacol Hydrogen Atom Transfer and Oxygen Rebound with Cytochrome P450 Enzyme GcoA. The journal of physical chemistry. B 125 (13) (2021)
Qianyi Cheng, Nathan J DeYonker
Acylation and deacylation mechanism and kinetics of penicillin G reaction with Streptomyces R61 DD-peptidase. Journal of computational chemistry 41 (18) (2020)
Qianyi Cheng, InSuk Joung, Juyong Lee, Kunihiro Kuwajima, Jooyoung Lee
Exploring the Folding Mechanism of Small Proteins GB1 and LB1. Journal of chemical theory and computation 15 (6) (2019)
Thomas J Summers, Baty P Daniel, Qianyi Cheng, Nathan J DeYonker
Quantifying Inter-Residue Contacts through Interaction Energies. Journal of chemical information and modeling 59 (12) (2019)