Exploring the interaction of Cu-modified B12N12 nanocages for Favipiravir drug delivery using density functional theory study

被引：0
|
作者：
Matin, Mohammad A. [1 ]
Saha, Joyanta K. [2 ]
Debnath, Tapas [3 ]
Jang, Joonkyung [4 ]
机构：
[1] Computing Research Laboratory, Centre for Advanced Research in Sciences (CARS), Dhaka University, Dhaka,1000, Bangladesh
[2] Department of Chemistry, Jagannath University, Dhaka,1100, Bangladesh
[3] Department of Theoretical and Computational Chemistry, Dhaka University, Dhaka,1000, Bangladesh
[4] Department of Nanoenergy Engineering, Pusan National University, Busan,46241, Korea, Republic of
来源：
Journal of Molecular Liquids | 2024年 / 414卷
关键词：
Compendex;
D O I：
10.1016/j.molliq.2024.125999
中图分类号：
学科分类号：
摘要：
Molecular orbitals
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