Spectroscopic Quantum Calculations Using Density Functional Theory and Molecular Docking Simulations on 2-(4-Methoxystyryl)-4,6-Bis(Trichloromethyl)-1,3,5-Triazine as Potent Inhibitor against SARS-CoV-2,Polycyclic Aromatic Compounds

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Spectroscopic Quantum Calculations Using Density Functional Theory and Molecular Docking Simulations on 2-(4-Methoxystyryl)-4,6-Bis(Trichloromethyl)-1,3,5-Triazine as Potent Inhibitor against SARS-CoV-2
Polycyclic Aromatic Compounds ( IF 2.4 ) Pub Date : 2023-11-09 , DOI: 10.1080/10406638.2023.2276865
Annu , B. S. Yadav ₁ , Jayant Teotia ₁

Affiliation

The present investigation is insightful in discerning the experimental and computational spectroscopic behavior of 2-(4-methoxystyryl)-4,6-bis(trichloromethyl)-1,3,5 triazine (MSTCMT) by employing ...

中文翻译：

使用密度泛函理论和分子对接模拟对 2-(4-甲氧基苯乙烯基)-4,6-双(三氯甲基)-1,3,5-三嗪作为 SARS-CoV-2 有效抑制剂进行光谱量子计算

本研究通过采用...洞察 2-(4-甲氧基苯乙烯基)-4,6-双(三氯甲基)-1,3,5 三嗪 (MSTCMT) 的实验和计算光谱行为。

更新日期：2023-11-12

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