Effect of the polarity of functional groups (-H, -OH, and -COOH) on the structure of a solvent near single-wall carbon nanopipes

DFT studies of CNT–functionalized uracil-acetate hybrids

“…Therefore, studies of formations and properties of hybrids of nano-based structures and medicinal species have become the topics of several computational and experimental research works in recent years [13][14][15][16]. In addition to the benefits of nano-based structures for medicinal purposes, the hydrophobicity of non-polar nano-materials e.g., CNTs, could be significantly reduced in contribution with biological hybrids [17]. Since the hydrophobic nano-materials could not be easily dispersed in solutions, a biological coverage could help them to overcome the problem [18].…”