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中文摘要：
用量子化学方法，研究萤火虫等生物荧光的化学反应机理，确认生物荧光物质的分子结构，分析荧光物质、活性点分子结构与生物荧光颜色之间的关系以及发光分子周围环境对生物荧光颜色的影响，探索生物多色发光的化学起源，找出产生特定荧光波长的条件。进一步将其应用于新型生物发光材料的分子设计研究中，通过分子设计从理论上找出一些满足实践需要的，在所期望的波段有高效荧光的生物荧光材料备选分子。
结论摘要：
英文主题词firefly;bioluminescence;the relations between the emitter;active site structure and bioluminescence color
成果综合统计
期刊论文
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期刊论文
A Time-Dependent Density Functional Theory Investigation on the Origin of Red Chemiluminescence --Th
Theoretical study of one-photon and two-photon absorption properties for 2,1,3-benzothiadiazole-base
Theoretical studies on the electronic and optical properties of a new class of aromatic oligomers an
Theoretical study on perylene tetracarboxylic derivatives with large two-photon absorption cross-sec
Theoretical Study on Photophysical Properties of Multifunctional Electroluminescent Molecules with D
TDDFT study of the electronic structure, absorption and emission spectra of the light emitters of th
Theoretical study on photophysical properties of bis-dipolar diphenylamino-endcapped oligoarylfluore
Theoretical study of one-photon and two-photon absorption properties of perylene tetracarboxylic der
A density functional theory study on photophysical properties of red light-emitting materials: Meso-
Theoretical investigation of oligo(fluorene) derivatives containing electron-deficient unit 2-pyran-
Theoretical study of solvent effect on one- and two-photon absorption properties of starburst DCM de
Theoretical Study of One- and Two-photon Absorption Properties for Two Series of Star-burst-typed Ps
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