Physicochemical Characterization of Antiviral Phytochemicals of Artemisia annua Plant as Therapeutic Potential against Coronavirus Disease: In Silico-Drug Delivery by Density Functional Theory Benchmark
Yazarlar (3)
Dr. Öğr. Üyesi Fatemeh MOLLAAMIN Kastamonu University, Türkiye
Prof. Dr. Majıd MONAJJEMI Islamic Azad University, Central Tehran Branch, İran
Samira Mohammadi
Islamic Azad University, Central Tehran Branch, İran
Makale Türü Açık Erişim Özgün Makale (ESCI dergilerinde yayınlanan tam makale)
Dergi Adı Journal of Biological Regulators and Homeostatic Agents
Dergi ISSN 0393-974X Wos Dergi Scopus Dergi
Makale Dili İngilizce Basım Tarihi 07-2023
Cilt / Sayı / Sayfa 37 / 7 / 3629–3639 DOI 10.23812/j.biol.regul.homeost.agents.20233707.358
Makale Linki https://unis.kastamonu.edu.tr/yayin-detay/2_CpCtCJ4_55/physicochemical-characterization-of-antiviral-phytochemicals-of-artemisia-annua-plant-as-therapeutic-potential-against-coronavirus-disease-in-silico-drug-delivery-by-density-functional-theory-ben
UAK Araştırma Alanları
Fiziksel Kimya
Özet
Background By increasing Coronavirus disease pandemic, Artemisia annua and its phytocomponents with their biological activities containing anti-inflammatory, antibacterial and antioxidant have been investigated as the antivirus. The purpose of this research article is to measure physical and physicochemical properties of Artemisia annua and its component derivatives to approve the effectiveness of these compounds for fighting against the severe acute respiratory syndrome coronavirus 2 infection using carbon nanotube as nanocarrier through drug delivery method. Methods The physical and physicochemical properties of dipole moment, thermochemistry of infrared spectroscopy, chemical shielding tensors of nuclear magnetic resonance, charge density, electrostatic potential and electron donating and electron accepting through frontier orbitals have been evaluated using density functional theory and m062x …
Anahtar Kelimeler
Artemisia annua | Coronavirus disease | density functional theory | drug delivery | phytomedicine