Identification of Small Molecule Inhibitors against Staphylococcus aureus Dihydroorotase via HTS

AJ Rice, RP Pesavento, J Ren, I Youn, Y Kwon… - International Journal of …, 2021 - mdpi.com
Drug-resistant Staphylococcus aureus is an imminent threat to public health, increasing the
importance of drug discovery utilizing unexplored bacterial pathways and enzyme targets …

Water‐soluble cationic polymers and their polymer–metal complexes with biocidal activity: A genotoxicity study

BL Rivas, ED Pereira, MA Mondaca… - Journal of applied …, 2003 - Wiley Online Library
Water‐soluble polyelectrolytes containing ammonium and sulfonic groups, their polymer–Ag
(I) complexes, and silver nitrate were investigated as bactericidal compounds for …

Solid state simulation of tetramer form of 5-aminoorotic acid: The vibrational spectra and molecular structure study by using MP2 and DFT calculations

S Ortiz, MA Palafox, VK Rastogi, R Tomer - Spectrochimica Acta Part A …, 2012 - Elsevier
The Raman and IR spectra of the biomolecule 5-aminoorotic acid in the solid state were
simulated by a dimer and tetramer forms, with the special interest in the interactions that …

Targeting Aspartate Transcarbamoylase: A Versatile Approach to Multispecies Drug and Herbicide Discovery

X Du - 2024 - research.rug.nl
This thesis primarily focuses on the identification and study of new drug target essential in
nucleic acid metabolism, specifically the catalytic step supported by aspartate …

The performance of the X3LYP, M052X and M062X DFT methods in the study of the vibrational spectra of the biomolecule 5-Aminoorotic acid

MA Palafox, K Rani, W Kiefer, SP Singh, MJ Alam… - asianjournalofphysics.com
A DFT study of the biomolecule of 5-aminoorotic acid (HAOA) has been carried out with the
M052X and M062X methods using the Gaussian 09 program package for the first time. The …