Universal nanohydrophobicity predictions using virtual nanoparticle library

Universal nanohydrophobicity predictions using virtual nanoparticle library

Abstract To facilitate the development of new nanomaterials, especially nanomedicines, a novel computational approach was developed to precisely predict the hydrophobicity of gold nanoparticles (GNPs). The core of this study was to develop a large virtual gold nanoparticle (vGNP) library with comput...

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Bibliographic Details
Main Authors: Wenyi Wang, Xiliang Yan, Linlin Zhao, Daniel P. Russo, Shenqing Wang, Yin Liu, Alexander Sedykh, Xiaoli Zhao, Bing Yan, Hao Zhu
Format: Article
Language:English
Published: BMC 2019-01-01
Series:Journal of Cheminformatics
Subjects:
Nanohydrohobicity
Surface chemistry
Surface simulations
Nanomaterials design
Virtual nanoparticle library
Predictive model
Online Access:http://link.springer.com/article/10.1186/s13321-019-0329-8

Internet

http://link.springer.com/article/10.1186/s13321-019-0329-8

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