Search Page
Save citations to file
Email citations
Send citations to clipboard
Add to Collections
Add to My Bibliography
Create a file for external citation management software
Your saved search
Your RSS Feed
Search Results
3 results
Filters applied: . Clear all
Results are displayed in a computed author sort order.
The Results By Year timeline is not available.
Page 1
The influence of model building schemes and molecular dynamics sampling on QM-cluster models: the chorismate mutase case study.
Phys Chem Chem Phys. 2024 Apr 24;26(16):12467-12482. doi: 10.1039/d3cp06100k.
Phys Chem Chem Phys. 2024.
PMID: 38618904
Evaluating the active site-substrate interplay between x-ray crystal structure and molecular dynamics in chorismate mutase.
Summers TJ, Hemmati R, Miller JE, Agbaglo DA, Cheng Q, DeYonker NJ.
Summers TJ, et al. Among authors: agbaglo da.
J Chem Phys. 2023 Feb 14;158(6):065101. doi: 10.1063/5.0127106.
J Chem Phys. 2023.
PMID: 36792523
Item in Clipboard
Theoretical Rovibrational Spectroscopy of Magnesium Tricarbide-Multireference Character Thwarts a Full Analysis of All Isomers.
Agbaglo DA, Cheng Q, Fortenberry RC, Stanton JF, DeYonker NJ.
Agbaglo DA, et al.
J Phys Chem A. 2022 Jul 7;126(26):4132-4146. doi: 10.1021/acs.jpca.2c01340. Epub 2022 Jun 27.
J Phys Chem A. 2022.
PMID: 35758849
Item in Clipboard
Cite
Cite