Nathan J DeYonker

Publication Activity (10 Years)

Years Active: 2018-2024
Publications (10 Years): 20

Top Topics

Magnetic Resonance Imaging

Highly Efficient

Crystal Structure

Top Venues

Inorganic chemistry

Physical chemistry chemical physics : PCCP

The journal of physical chemistry. B

The journal of physical chemistry. A

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)
Natalie S Taylor, Maxwell T Gordinier, Tejaskumar Suhagia, Danna D Pinto, Demetrius D Cherry, Dominic S Verry, Lindsey N Baker, Nathan J DeYonker, Karin J Young, Timothy P Brewster
Donor Ability of Bisphosphinemonoxide Ligands Relevant to Late-Metal Olefin Polymerization Catalysis. Inorganic chemistry 63 (6) (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)
Natalie S Taylor, Maxwell T Gordinier, Tejaskumar Suhagia, Danna D Pinto, Demetrius D Cherry, Dominic S Verry, Lindsey N Baker, Nathan J DeYonker, Karin J Young, Timothy P Brewster
Donor Ability of Bisphosphinemonoxide Ligands Relevant to Late-Metal Olefin Polymerization Catalysis. Inorganic chemistry 63 (6) (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)
Natalie S Taylor, Maxwell T Gordinier, Tejaskumar Suhagia, Danna D Pinto, Demetrius D Cherry, Dominic S Verry, Lindsey N Baker, Nathan J DeYonker, Karin J Young, Timothy P Brewster
Donor Ability of Bisphosphinemonoxide Ligands Relevant to Late-Metal Olefin Polymerization Catalysis. Inorganic chemistry (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)
Marco Fioroni, Nathan J DeYonker
Nitrile regio-synthesis by Ni centers on a siliceous surface: implications in prebiotic chemistry. Chemical communications (Cambridge, England) 58 (82) (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)
Ryan C Fortenberry, Nathan J DeYonker
Rovibrational Quantum Chemical Treatment of Inorganic and Organometallic Astrochemicals. Accounts of chemical research 54 (2) (2020)
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)
Wyatt Thornley, Sarah A Wirick, Maximilian Riedel-Topper, Nathan J DeYonker, Thomas E Bitterwolf, Christopher J Stromberg, Edwin J Heilweil
Photodynamics of [FeFe]-Hydrogenase Model Compounds with Bidentate Heterocyclic Ligands. The journal of physical chemistry. B 123 (33) (2019)
R Malcolm Charles Iii, Timothy W Yokley, Nathan D Schley, Nathan J DeYonker, Timothy P Brewster
Hydrogen Activation and Hydrogenolysis Facilitated By Late-Transition-Metal-Aluminum Heterobimetallic Complexes. Inorganic chemistry 58 (19) (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)
Timothy P Brewster, Tan H Nguyen, Zhongjing Li, William T Eckenhoff, Nathan D Schley, Nathan J DeYonker
Synthesis and Characterization of Heterobimetallic Iridium-Aluminum and Rhodium-Aluminum Complexes. Inorganic chemistry 57 (3) (2018)
Marjorie Torres, Sidrah Khan, Michael Duplanty, Hannah C Lozano, Tyree J Morris, Trang Nguyen, Yuri V Rostovtsev, Nathan J DeYonker, Nasrin Mirsaleh-Kohan
Raman and Infrared Studies of Platinum-Based Drugs: Cisplatin, Carboplatin, Oxaliplatin, Nedaplatin, and Heptaplatin. The journal of physical chemistry. A 122 (34) (2018)
Marco Fioroni, A Kelly Tartera, Nathan J DeYonker
Propylene Oxide Formation on a Silica Surface with Peroxo Defects: Implications in Astrochemistry. The journal of physical chemistry. A 122 (46) (2018)