Effects of solvents on the adsorption selectivity of molecularly imprinted polymers: Molecular simulation and experimental validation

2007 ◽  
Vol 53 (2) ◽  
pp. 183-188 ◽  
Author(s):  
Wenguo Dong ◽  
Ming Yan ◽  
Zheng Liu ◽  
Guoshi Wu ◽  
Yanmei Li
Keyword(s):  
Molecular Simulation ◽  
Molecularly Imprinted Polymers ◽  
Experimental Validation ◽  
Adsorption Selectivity ◽  
Molecularly Imprinted ◽  
Imprinted Polymers

Preparation and adsorption selectivity of rutin molecularly imprinted polymers

2011 ◽  
Vol 123 (2) ◽  
pp. 903-912 ◽  
Author(s):  
Yu Fu ◽  
Zhenbin Chen ◽  
Hui Yu ◽  
Yumin Yue ◽  
Duolong Di
Keyword(s):  
Molecularly Imprinted Polymers ◽  
Adsorption Selectivity ◽  
Molecularly Imprinted ◽  
Imprinted Polymers

Sythesis of Molecularly Imprinted Polymers for the Binding and Recognition of Nonylphenol

2013 ◽  
Vol 641-642 ◽  
pp. 55-59 ◽  
Author(s):  
Yan Jie Bi ◽  
Wen Yan Li ◽  
Chen Yuan ◽  
Bin Song Wang
Keyword(s):  
Molecularly Imprinted Polymers ◽  
High Selectivity ◽  
Sol Gel ◽  
Template Molecule ◽  
Binding Properties ◽  
Adsorption Selectivity ◽  
Molecularly Imprinted ◽  
Imprinted Polymers ◽  
Selective Enrichment ◽  
Sol Gel Process

In this paper, molecularly imprinted polymers with high selectivity for nonylphenol (NP) were synthesized by sol-gel process using 4-vinylpyridine (4-Vpy) as functional monomer, ethyleneglycol dimethacrylate as crosslinker (EGDMA), azobisisobutyronitrile (AIBN) as initiator, NP as template molecules. The performance of imprinted material was evaluated by adsorption kinetic, adsorption isotherm and adsorption selectivity. The results indicated that this material had not only binding properties but also high selectivity to the template molecule, which had good application prospects in the selective enrichment and separation of NP for pretreatment and analysis of complex environmental samples.

scholarly journals A Review on Molecularly Imprinted Polymers Preparation by Computational Simulation-Aided Methods

Polymers ◽  
2021 ◽  
Vol 13 (16) ◽  
pp. 2657
Author(s):  
Zhimin Liu ◽  
Zhigang Xu ◽  
Dan Wang ◽  
Yuming Yang ◽  
Yunli Duan ◽  
...  
Keyword(s):  
Molecular Simulation ◽  
Molecularly Imprinted Polymers ◽  
Computational Simulation ◽  
Optimization Methods ◽  
Intermolecular Forces ◽  
Template Molecule ◽  
Molecularly Imprinted ◽  
Functional Monomers ◽  
Imprinted Polymers ◽  
Molecular Imprinting Technology

Molecularly imprinted polymers (MIPs) are obtained by initiating the polymerization of functional monomers surrounding a template molecule in the presence of crosslinkers and porogens. The best adsorption performance can be achieved by optimizing the polymerization conditions, but this process is time consuming and labor-intensive. Theoretical calculation based on calculation simulations and intermolecular forces is an effective method to solve this problem because it is convenient, versatile, environmentally friendly, and inexpensive. In this article, computational simulation modeling methods are introduced, and the theoretical optimization methods of various molecular simulation calculation software for preparing molecularly imprinted polymers are proposed. The progress in research on and application of molecularly imprinted polymers prepared by computational simulations and computational software in the past two decades are reviewed. Computer molecular simulation methods, including molecular mechanics, molecular dynamics and quantum mechanics, are universally applicable for the MIP-based materials. Furthermore, the new role of computational simulation in the future development of molecular imprinting technology is explored.

Effect of variable conditions on the adsorption selectivity of molecularly imprinted polymers

2018 ◽  
Vol 1 (4) ◽  
pp. 777-784
Author(s):  
Ke Li ◽  
Zhenbin Chen ◽  
Dong Lei Liu ◽  
Xin Yu Zhang ◽  
Juan M. Ruso ◽  
...  
Keyword(s):  
Molecularly Imprinted Polymers ◽  
Adsorption Selectivity ◽  
Molecularly Imprinted ◽  
Imprinted Polymers

Preparation of Benzonic Acid Molecularly Imprinted Polymers and Its Adsorption Property

2010 ◽  
Vol 38 (3) ◽  
pp. 401-404
Author(s):  
Da-Wei LOU ◽  
Ying-Jie YANG ◽  
Guang HUANG ◽  
Ping-Li PU ◽  
Xin-Qing LEE ◽  
...  
Keyword(s):  
Molecularly Imprinted Polymers ◽  
Adsorption Property ◽  
Molecularly Imprinted ◽  
Imprinted Polymers
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