A CAM-B3LYP DFT Investigation of Atenolol Adsorption on the Surface of Boron Nitride and Carbon Nanotubes and Effect of Surface Carboxylic Groups

被引：0

作者：

机构：

[1] Young Researchers and Elite Club,

[2] Rasht Branch,undefined

[3] Islamic Azad University,undefined

[4] Department of Chemistry,undefined

[5] Rasht Branch,undefined

[6] Islamic Azad University,undefined

来源：

Russian Journal of Physical Chemistry A | 2020年 / 94卷

关键词：

non-covalent interaction; density functional theory; drug delivery; natural bond orbital;

D O I：

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摘要：

引用

页码：1678 / 1693

页数：15

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