Related references
Note: Only part of the references are listed.Challenges in Simulating Light-Induced Processes in DNA
Philipp Marquetand et al.
MOLECULES (2017)
UV-Induced Charge Transfer States in DNA Promote Sequence Selective Self-Repair
Dominik Benjamin Bucher et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2016)
UV-induced DNA Damage: The Role of Electronic Excited States
Dimitra Markovitsi
PHOTOCHEMISTRY AND PHOTOBIOLOGY (2016)
High-Energy Long-Lived Mixed Frenkel-Charge-Transfer Excitons: From Double Stranded (AT)n to Natural DNA
Ignacio Vaya et al.
CHEMISTRY-A EUROPEAN JOURNAL (2016)
Excimers and Exciplexes in Photoinitiated Processes of Oligonucleotides
Vincent A. Spata et al.
JOURNAL OF PHYSICAL CHEMISTRY LETTERS (2016)
Cyclobutane Thymine Photodimerization Mechanism Revealed by Nonadiabatic Molecular Dynamics
Clemens Rauer et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2016)
Characterization of the excited states of DNA building blocks: a coupled cluster computational study
Zsuzsanna Benda et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2016)
ff14SB: Improving the Accuracy of Protein Side Chain and Backbone Parameters from ff99SB
James A. Maier et al.
JOURNAL OF CHEMICAL THEORY AND COMPUTATION (2015)
Noncanonical Stacking Geometries of Nucleobases as a Preferred Target for Solar Radiation
Ruslan R. Ramazanov et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2015)
QM/MM studies reveal pathways leading to the quenching of the formation of thymine dimer photoproduct by flanking bases
Wook Lee et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2015)
New tools for the systematic analysis and visualization of electronic excitations. I. Formalism
Felix Plasser et al.
JOURNAL OF CHEMICAL PHYSICS (2014)
Role of Excitonic Coupling and Charge-Transfer States in the Absorption and CD Spectra of Adenine-Based Oligonucleotides Investigated through QM/MM Simulations
Vincent A. Spata et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2014)
Base Stacking in Adenosine Dimers Revealed by Femtosecond Transient Absorption Spectroscopy
Jinquan Chen et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2014)
Charge-Transfer Excited States in Aqueous DNA: Insights from Many-Body Green's Function Theory
Huabing Yin et al.
PHYSICAL REVIEW LETTERS (2014)
Multi-Pathway Excited State Relaxation of Adenine Oligomers in Aqueous Solution: A Joint Theoretical and Experimental Study
Akos Banyasz et al.
CHEMISTRY-A EUROPEAN JOURNAL (2013)
Routine Microsecond Molecular Dynamics Simulations with AMBER on GPUs. 2. Explicit Solvent Particle Mesh Ewald
Romelia Salomon-Ferrer et al.
JOURNAL OF CHEMICAL THEORY AND COMPUTATION (2013)
Effects of dynamic disorder on exciton delocalization and photoinduced charge separation in DNA
Alexander A. Voityuk
PHOTOCHEMICAL & PHOTOBIOLOGICAL SCIENCES (2013)
Electronic excitation and structural relaxation of the adenine dinucleotide in gas phase and solution
Felix Plasser et al.
PHOTOCHEMICAL & PHOTOBIOLOGICAL SCIENCES (2013)
Analysis of Excitonic and Charge Transfer Interactions from Quantum Chemical Calculations
Felix Plasser et al.
JOURNAL OF CHEMICAL THEORY AND COMPUTATION (2012)
UV Absorption Spectrum of Alternating DNA Duplexes. Analysis of Excitonic and Charge Transfer Interactions
Felix Plasser et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2012)
Effects of molecular dynamics and solvation on the electronic structure of molecular probes
Pasquale Caruso et al.
THEORETICAL CHEMISTRY ACCOUNTS (2012)
Interplay between Neutral and Charge-Transfer Excimers Rules the Excited State Decay in Adenine-Rich Polynucleotides
Roberto Improta et al.
ANGEWANDTE CHEMIE-INTERNATIONAL EDITION (2011)
The Charge-Transfer States in a Stacked Nucleobase Dimer Complex: A Benchmark Study
Adelia J. A. Aquino et al.
JOURNAL OF COMPUTATIONAL CHEMISTRY (2011)
Base Pairing Enhances Fluorescence and Favors Cyclobutane Dimer Formation Induced upon Absorption of UVA Radiation by DNA
Akos Banyasz et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2011)
Adenine deactivation in DNA resolved at the CASPT2//CASSCF/AMBER level
Irene Conti et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2010)
Relaxation mechanisms of UV-photoexcited DNA and RNA nucleobases
Mario Barbatti et al.
PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA (2010)
Quantum Chemistry on Graphical Processing Units. 3. Analytical Energy Gradients, Geometry Optimization, and First Principles Molecular Dynamics
Ivan S. Ufimtsev et al.
JOURNAL OF CHEMICAL THEORY AND COMPUTATION (2009)
Conformation Dependence of DNA Exciton Parentage
E. B. Starikov et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2009)
UV-Induced Structural Changes of Model DNA Helices Probed by Optical Spectroscopy
Akos Banyasz et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2009)
Excited States Decay of the A-T DNA: A PCM/TD-DFT Study in Aqueous Solution of the (9-Methyl-adenine)2•(1-methyl-thymine)2 Stacked Tetramer
F. Santoro et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2009)
Both Intra- and Interstrand Charge-Transfer Excited States in Aqueous B-DNA Are Present at Energies Comparable To, or Just Above, the 1ππ* Excitonic Bright States
Adrian W. Lange et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2009)
The Role of Adenine Excimers in the Photophysics of Oligonucleotides
Gloria Olaso-Gonzalez et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2009)
Calculations of the exciton coupling elements between the DNA bases using the transition density cube method
Arkadiusz Czader et al.
JOURNAL OF CHEMICAL PHYSICS (2008)
Electronic excitations and spectra in single-stranded DNA
Stefano Tonzani et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2008)
Strong coupling between adenine nucleobases in DNA single strands revealed by circular dichroism using synchrotron radiation
Umesh Kadhane et al.
PHYSICAL REVIEW E (2008)
UV excitation of single DNA and RNA strands produces high yields of exciplex states between two stacked bases
Tomohisa Takaya et al.
PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA (2008)
Are adenine strands helical H-aggregates?
LiHong Hu et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2007)
Ultrafast deactivation channel for thymine dimerization
Martial Boggio-Pasqua et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2007)
Excited states and energy transfer among DNA bases in double helices
Dimitra Markovitsi et al.
PHOTOCHEMICAL & PHOTOBIOLOGICAL SCIENCES (2007)
Influence of base stacking on excited-state behavior of polyadenine in water, based on time-dependent density functional calculations
F. Santoro et al.
PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA (2007)
Electronic energy delocalization and dissipation in single- and double-stranded DNA
Ivan Buchvarov et al.
PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA (2007)
Thymine dimerization in DNA is an ultrafast photoreaction
Wolfgang J. Schreier et al.
SCIENCE (2007)
Electronic coupling in the excited electronic state of stacked DNA base homodimers
Hans-Hermann Ritze et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2007)
Fluorescence of the DNA double helices (dAdT)(n)center dot(dAdT)(n) studied by femtosecond spectroscopy
Delphine Onidas et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2007)
Femtosecond time- and wavelength-resolved fluorescence and absorption spectroscopic study of the excited states of adenosine and an adenine oligomer
Wai-Ming Kwok et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2006)
Collective behavior of Franck-Condon excited states and energy transfer in DNA double helices
D Markovitsi et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2005)
Base stacking controls excited-state dynamics in A-T DNA
CE Crespo-Hernández et al.
NATURE (2005)
DNA lesions induced by UV A1 and B radiation in human cells:: Comparative analyses in the overall genome and in the p53 tumor suppressor gene
A Besaratinia et al.
PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA (2005)
UV spectra and excitation delocalization in DNA:: Influence of the spectral width
E Emanuele et al.
CHEMPHYSCHEM (2005)
A new hybrid exchange-correlation functional using the Coulomb-attenuating method (CAM-B3LYP)
T Yanai et al.
CHEMICAL PHYSICS LETTERS (2004)
Influence of conformational dynamics on the exciton states of DNA oligomers
B Bouvier et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2003)
UV-induced DNA damage and repair: a review
RP Sinha et al.
PHOTOCHEMICAL & PHOTOBIOLOGICAL SCIENCES (2002)
Dipolar coupling between electronic transitions of the DNA bases and its relevance to exciton states in double helices
B Bouvier et al.
CHEMICAL PHYSICS (2002)
Share Paper
