Quantum mechanical studies on the photophysics and the photochemistry of nucleic acids and nucleobases

R Improta, F Santoro, L Blancafort - Chemical reviews, 2016 - ACS Publications
The photophysics and photochemistry of DNA is of great importance due to the potential
damage of the genetic code by UV light. Quantum mechanical studies have played a key …

Mechanisms for DNA charge transport

JC Genereux, JK Barton - Chemical reviews, 2010 - ACS Publications
DNA charge transport (CT) chemistry has received considerable attention by scientific
researchers over the past 15 years since our first provocative publication on long-range CT …

Analysis of excitonic and charge transfer interactions from quantum chemical calculations

F Plasser, H Lischka - Journal of chemical theory and computation, 2012 - ACS Publications
A procedure for a detailed analysis of excited states in systems of interacting chromophores
is proposed. By considering the one-electron transition density matrix, a wealth of …

DNA excited-state dynamics: from single bases to the double helix

CT Middleton, K de La Harpe, C Su… - Annual review of …, 2009 - annualreviews.org
Ultraviolet light is strongly absorbed by DNA, producing excited electronic states that
sometimes initiate damaging photochemical reactions. Fully map** the reactive and …

Excited state dynamics of DNA bases

K Kleinermanns, D Nachtigallová… - International Reviews in …, 2013 - Taylor & Francis
Biochemical reactions are subject to the particular environmental conditions of planet earth,
including solar irradiation. How DNA responds to radiation is relevant to human health …

[HTML][HTML] Are the five natural DNA/RNA base monomers a good choice from natural selection?: A photochemical perspective

L Serrano-Andres, M Merchan - Journal of Photochemistry and …, 2009 - Elsevier
In order to prevent the damaging effects of sun radiation in the genetic material, its
constituent chromophores, the five natural DNA/RNA nucleobases cytosine, thymine, uracil …

Quantum chemical modeling of the photoinduced activity of multichromophoric biosystems: focus review

F Segatta, L Cupellini, M Garavelli… - Chemical reviews, 2019 - ACS Publications
Multichromophoric biosystems represent a broad family with very diverse members, ranging
from light-harvesting pigment–protein complexes to nucleic acids. The former are designed …

A doorway state leads to photostability or triplet photodamage in thymine DNA

WM Kwok, C Ma, DL Phillips - Journal of the American Chemical …, 2008 - ACS Publications
Ultraviolet irradiation of DNA produces electronic excited states that predominantly eliminate
the excitation energy by returning to the ground state (photostability) or following minor …

Electronic excited states responsible for dimer formation upon UV absorption directly by thymine strands: joint experimental and theoretical study

A Banyasz, T Douki, R Improta… - Journal of the …, 2012 - ACS Publications
The study addresses interconnected issues related to two major types of cycloadditions
between adjacent thymines in DNA leading to cyclobutane dimers (T<> Ts) and (6-4) …

UV excitation of single DNA and RNA strands produces high yields of exciplex states between two stacked bases

T Takaya, C Su, K de La Harpe… - Proceedings of the …, 2008 - pnas.org
Excited electronic states created by UV excitation of the diribonucleoside monophosphates
ApA, ApG, ApC, ApU, and CpG were studied by the femtosecond transient-absorption …