Photoreaction channels of the guanine-cytosine base pair explored by long-range corrected TDDFT calculations.
about
A 'bottom up', ab initio computational approach to understanding fundamental photophysical processes in nitrogen containing heterocycles, DNA bases and base pairs.Excited state proton-coupled electron transfer in 8-oxoG-C and 8-oxoG-A base pairs: a time dependent density functional theory (TD-DFT) study.Ultrafast electronic deactivation dynamics of the inosine dimer--a model case for H-bonded purine bases.Ultraviolet Absorption Induces Hydrogen-Atom Transfer in G⋅C Watson-Crick DNA Base Pairs in Solution.Solvent effects on the excited-state double proton transfer mechanism in the 7-azaindole dimer: a TDDFT study with the polarizable continuum model.A theoretical investigation of one-dimensional lithium-bonded chain: enhanced first hyperpolarizability and little red-shift.Ultrafast excited-state deactivation of 9-methylhypoxanthine in aqueous solution: A QM/MM MD study.Role of Electron-Driven Proton-Transfer Processes in the Ultrafast Deactivation of Photoexcited Anionic 8-oxoGuanine-Adenine and 8-oxoGuanine-Cytosine Base Pairs.Non-radiative deactivation in phenol-pyridine complex: theoretical study.Dynamics of the excited-state hydrogen transfer in a (dG)·(dC) homopolymer: intrinsic photostability of DNA
P2860
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P2860
Photoreaction channels of the guanine-cytosine base pair explored by long-range corrected TDDFT calculations.
description
2012 nî lūn-bûn
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name
Photoreaction channels of the ...... corrected TDDFT calculations.
@en
Photoreaction channels of the ...... corrected TDDFT calculations.
@nl
type
label
Photoreaction channels of the ...... corrected TDDFT calculations.
@en
Photoreaction channels of the ...... corrected TDDFT calculations.
@nl
prefLabel
Photoreaction channels of the ...... corrected TDDFT calculations.
@en
Photoreaction channels of the ...... corrected TDDFT calculations.
@nl
P2860
P356
P1476
Photoreaction channels of the ...... corrected TDDFT calculations.
@en
P2093
Shohei Yamazaki
Tetsuya Taketsugu
P2860
P304
P356
10.1039/C2CP23867E
P407
P577
2012-05-17T00:00:00Z