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Relative stabilities and self-alignment tendencies of peptide-based NLO materials

机译:肽基NLO材料的相对稳定性和自对准趋势

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Abstract: s are being made to produce nonlinear optical (NLO) polymers by capitalizing on self-alignment properties of peptides by the formation of a beta pleated sheet. Such polymers contain both hydrophilic chromophores and hydrophobic side chains in which selective wetting on a water surface using Langmuir- Blodgett techniques creates a first-order approximation of the oriented film. Assembly to the planar beta pleated sheet structure should further enhance the oriented chromophoric structure of the extended mass. However, this requires stabilization through both hydrogen bonding and through energetically stable conformations. It is this stabilization which will favor the enhanced chromophore alignment during the deposition processes. Previous experimental peptides using leucine-based hydrophobic groups and dinitrophenyl-based hydrophilic chromophores have shown limited success in formation of the oriented films. Because it is desirable to be able to predict the effects of the side chain on orientational properties we have added molecular modeling to our general synthetic strategies, in order to analyze the possible affects of the primary structure on the beta sheet. !0
机译:摘要:通过利用形成β褶的片材利用肽的自对准特性来制备非线性光学(NLO)聚合物。这样的聚合物既包含亲水性发色团,又包含疏水性侧链,其中使用Langmuir-Blodgett技术在水表面选择性润湿会形成取向膜的一阶近似值。组装到平面β折叠片结构应进一步增强扩展质量的定向发色结构。然而,这需要通过氢键和通过能量稳定的构象来稳定。正是这种稳定化将有利于在沉积过程中增强发色团的排列。先前使用基于亮氨酸的疏水基团和基于二硝基苯基的亲水性发色团的实验肽在形成定向膜方面显示出有限的成功。因为希望能够预测侧链对取向特性的影响,所以我们在常规合成策略中添加了分子模型,以便分析一级结构对β折叠的可能影响。 !0

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