@article{paperid:1103414,
author = {Afrough, Toktam and Noroozi Shad, Nazanin and Seddighi, Mohammadjavad and ,  and Eshghi, Hossein},
title = {Novel pyrimidine-based derivatives as potential SARS-CoV-2 Mpro inhibitors: Synthesis, computational insights, and conformational dynamics},
journal = {Journal of Molecular Structure},
year = {2025},
volume = {1344},
number = {1},
month = {November},
issn = {0022-2860},
pages = {142901--142916},
			numpages = {15},
keywords = {SARS-CoV-2 main protease (Mpro)
Antiviral drug design
Pyrimidine derivatives
Molecular dynamics
Synthesis methodology
Docking studies},
}