Density functional and molecular docking studies towards investigating the role of single-wall carbon nanotubes as nanocarrier for loading and delivery of pyrazinamide antitubercular drug onto pncA protein

标题
Density functional and molecular docking studies towards investigating the role of single-wall carbon nanotubes as nanocarrier for loading and delivery of pyrazinamide antitubercular drug onto pncA protein
作者
关键词
Carbon nanotubes, Functionalization, Density functional theory, Protein-nanotube interaction, Docking
出版物
JOURNAL OF COMPUTER-AIDED MOLECULAR DESIGN
Volume 27, Issue 3, Pages 257-276
出版商
Springer Nature
发表日期
2013-02-14
DOI
10.1007/s10822-013-9638-6

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