Sequence dependence on DNA photochemistry: a computational study of photodimerization pathways in TpdC and dCpT dinucleotides

Photophysics of Deoxycytidine and 5-Methyldeoxycytidine in Solution: A Comprehensive Picture by Quantum Mechanical Calculations and Femtosecond Fluorescence Spectroscopy

(2017) L. Martínez-Fernández et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Novel adenine/thymine photodimerization channels mapped by PCM/TD-DFT calculations on dApT and TpdA dinucleotides

(2017) Lara Martínez-Fernández et al.   PHOTOCHEMICAL & PHOTOBIOLOGICAL SCIENCES

Conformational and electronic effects on the formation of anti cyclobutane pyrimidine dimers in G-quadruplex structures

(2017) Wook Lee et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Quantum Mechanical Studies on the Photophysics and the Photochemistry of Nucleic Acids and Nucleobases

(2016) Roberto Improta et al.   CHEMICAL REVIEWS

Effect of C5-Methylation of Cytosine on the UV-Induced Reactivity of Duplex DNA: Conformational and Electronic Factors

(2016) Akos Banyasz et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Excimers and Exciplexes in Photoinitiated Processes of Oligonucleotides

(2016) Vincent A. Spata et al.   Journal of Physical Chemistry Letters

Excited State Pathways Leading to Formation of Adenine Dimers

(2016) Akos Banyasz et al.   Journal of Physical Chemistry Letters

Cyclobutane Thymine Photodimerization Mechanism Revealed by Nonadiabatic Molecular Dynamics

(2016) Clemens Rauer et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Early Events of DNA Photodamage

(2015) Wolfgang J. Schreier et al.   Annual Review of Physical Chemistry

UV-induced DNA Damage: The Role of Electronic Excited States

(2015) Dimitra Markovitsi   PHOTOCHEMISTRY AND PHOTOBIOLOGY

QM/MM studies reveal pathways leading to the quenching of the formation of thymine dimer photoproduct by flanking bases

(2015) Wook Lee et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Computational Reference Data for the Photochemistry of Cyclobutane Pyrimidine Dimers

(2014) Mario Barbatti   CHEMPHYSCHEM

Effect of C5-Methylation of Cytosine on the Photoreactivity of DNA: A Joint Experimental and Computational Study of TCG Trinucleotides

(2014) Luciana Esposito et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Photoinduced Formation Mechanism of the Thymine–Thymine (6–4) Adduct

(2013) Angelo Giussani et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Sequence-dependent thymine dimer formation and photoreversal rates in double-stranded DNA

(2013) Yu Kay Law et al.   PHOTOCHEMICAL & PHOTOBIOLOGICAL SCIENCES

The variety of UV-induced pyrimidine dimeric photoproducts in DNA as shown by chromatographic quantification methods

(2013) Thierry Douki   PHOTOCHEMICAL & PHOTOBIOLOGICAL SCIENCES

Thymine photodimer formation in DNA hairpins. Unusual conformations favor (6 − 4) vs. (2 + 2) adducts

(2013) Mahesh Hariharan et al.   PHOTOCHEMICAL & PHOTOBIOLOGICAL SCIENCES

Photophysics and Photochemistry of Thymine Deoxy-Dinucleotide in Water: A PCM/TD-DFT Quantum Mechanical Study

(2012) Roberto Improta   JOURNAL OF PHYSICAL CHEMISTRY B

Electronic Excited States Responsible for Dimer Formation upon UV Absorption Directly by Thymine Strands: Joint Experimental and Theoretical Study

(2012) Akos Banyasz et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Base Pairing Enhances Fluorescence and Favors Cyclobutane Dimer Formation Induced upon Absorption of UVA Radiation by DNA

(2011) Akos Banyasz et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Photosensitised pyrimidine dimerisation in DNA

(2011) M. Consuelo Cuquerella et al.   Chemical Science

Conformational Control of TT Dimerization in DNA Conjugates. A Molecular Dynamics Study

(2010) Martin McCullagh et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Cyclobutane Pyrimidine Photodimerization of DNA/RNA Nucleobases in the Triplet State

(2010) Teresa Climent et al.   Journal of Physical Chemistry Letters

Conformational Control of Thymine Photodimerization in Single-Strand and Duplex DNA Containing Locked Nucleic Acid TT Steps

(2010) Mahesh Hariharan et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

On the photoproduction of DNA/RNA cyclobutane pyrimidine dimers

(2010) Israel González-Ramírez et al.   THEORETICAL CHEMISTRY ACCOUNTS

Density Functionals with Broad Applicability in Chemistry

(2008) Yan Zhao et al.   ACCOUNTS OF CHEMICAL RESEARCH

Predicting Thymine Dimerization Yields from Molecular Dynamics Simulations

(2008) Yu Kay Law et al.   BIOPHYSICAL JOURNAL

Theoretical Insight into the Intrinsic Ultrafast Formation of Cyclobutane Pyrimidine Dimers in UV-Irradiated DNA: Thymine versus Cytosine

(2008) Juan José Serrano-Pérez et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Molecular Basis of DNA Photodimerization: Intrinsic Production of Cyclobutane Cytosine Dimers

(2008) Daniel Roca-Sanjuán et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

The excited states of π-stacked 9-methyladenine oligomers: a TD-DFT study in aqueous solution

(2008) Roberto Improta   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

The Sugar Conformation Governs (6-4) Photoproduct Formation at the Dinucleotide Level

(2007) Céline Desnous et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY