位置：成果数据库 > 期刊 > 期刊详情页
A theoretical study on dual fluorescence of 4-dimethylaminopyridine by polarizable continuum model
  • 时间：0
  • 相关项目：有机体系光诱导电子转移及其溶剂效应
同期刊论文项目
有机体系光诱导电子转移及其溶剂效应
期刊论文 29
同项目期刊论文
基于支持向量学习机的HIV-1蛋白酶抑制剂的活性预测
A study on orientation and absorption spectrum of interfacial molecules by using continuum model
Solvent reorganization energy of intramolecular electron transfer in peptides involving tryptophan a
丙酮分子跃迁光谱的平均溶剂静电势/分子动力学方法研究
导体－溶剂界面电子转移溶剂重组能的球－界面模型
New formulation for non-equilibrium solvation: Spectral shifts and cavity radii of 6-propanoyl-2(N,N
基于三维分子描述符的埃坡霉素类衍生物抗癌活性预测
二氯二氰基苯醌及其阴离子自交换电子转移反应的理论研究
Accurate prediction of thermodynamic properties of alkyl peroxides by combining density functional t
Continuous medium theory for non-equilibrium solvation: IV. Solvent reorganization energy of electro
Thermodynamics for nonequilibrium solvation and numerical evaluation of solvent reorganization energ
HYDRATION FREE ENERGY AND ABSORPTION SPECTRUM OF AN EXTRA ELECTRON IN WATER BY QUANTUM-CONTINUUM MOD
Single-sphere model for solvent reorganization energy and its application to electron transfer
Solvent reorganization energy of electron transfer by a modified ellipsoidal cavity model
Theoretical investigation of spectral properties and tautomerization mechanism of 2-aminopurine
A single sphere model for absorption spectrum of interface molecule and its application to predicati
Explicit solvent model for spectral shift of acrolein and simulation with molecular dynamics
细菌紫红质中APS85和APS212在质子转移的分子模拟
Solvent reorganization energy and electronic coupling for intrarnolecular electron transfer in biphe
An ab initio/Rice-Ramsperger-Kassel-Marcus prediction of rate constant and product branching ratios
细菌紫红质中氢键相互作用和质子转移机理的分子模拟
电子转移溶剂重组能的单球模型及其应用