Keto-Enol Tautomer of Uracil and Thymine (original) (raw)
Correlated ab initio study of nucleic acid bases and their tautomers in the gas phase, in a microhydrated environment and in aqueous solution. Part 4. Uracil and thymine
Manuel Rueda
Physical Chemistry Chemical Physics, 2005
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Tautomeric equilibrium of uracil and thymine in model protein-nucleic acid contacts. Spectroscopic and quantum chemical approach.
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Vibrational Spectroscopy: A tool for characterization of nucleic acid constituents: Cytosine and Uracil
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Anion spectroscopy of uracil, thymine and the amino-oxo and amino-hydroxy tautomers of cytosine and their water clusters
R. Weinkauf
Chemical Physics, 1998
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Excited states of protonated DNA/RNA bases
Matias Berdakin
Physical Chemistry Chemical Physics, 2014
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Tautomerism of nucleic acid bases. I. Cytosine
Sunney Chan
Journal of the American Chemical Society, 1972
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An experimental and theoretical vibrational study of 3,3,6,6-tetramethyl-1,2,4,5-tetrathiane
juan zinczuk
Vibrational Spectroscopy, 2015
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A theoretical and experimental investigation of the electronic spectra and tautomerization of nucleobases
Rifaat Hilal
Biophysical Chemistry, 1995
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Ground and Excited States of Gas-Phase DNA Nucleobase Cation-Radicals. A UV–vis Photodisociation Action Spectroscopy and Computational Study of Adenine and 9-Methyladenine
Andy Dang
Journal of the American Society for Mass Spectrometry, 2020
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Possibility of distinguishing DNA bases and of tracking the keto–enol tautomerism by using high-order harmonic generation
Cẩm Tú Lê
Computational and Theoretical Chemistry, 2014
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Quantum-chemical modeling of the tautomeric equilibria of modified anionic nucleic acid bases
Mati Karelson, Andre Lomaka
Arkivoc, 2002
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Bond Breaking and Temporary Anion States in Uracil and Halouracils: Implications for the DNA Bases
P. Burrow, Adam Scheer
Physical Review Letters, 2004
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Tautomers of cytosine and their excited electronic states: a matrix isolation spectroscopic and quantum chemical study
Geza Fogarasi
Physical Chemistry Chemical Physics, 2011
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Infrared laser spectroscopy of uracil in a pulsed slit jet
Richard Saykally
The Journal of Chemical Physics, 1995
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Singlet−Triplet Energy Gaps of Gas-Phase RNA and DNA Bases. A Quantum Chemical Study
Arnout Ceulemans
The Journal of Physical Chemistry A, 2004
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Electronic Excited-States Properties of the Purine Nucleoside Bases of DNA at Room Temperature
Anas M. Ababneh
2007
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Photophysics of Methyl-Substituted Uracils and Thymines and Their Water Complexes in the Gas Phase
Yonggang He
Journal of Physical Chemistry A, 2004
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The physicochemical essence of the purine·pyrimidine transition mismatches with Watson-Crick geometry in DNA: A·C* versa A*·C. A QM and QTAIM atomistic understanding
D. Hovorun
Journal of Biomolecular Structure and Dynamics, 2013
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Solvent Effects on the Steady-state Absorption and Fluorescence Spectra of Uracil, Thymine and 5-Fluorouracil
Roberto Improta
Photochemistry and Photobiology, 2007
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Recent aspects of the photochemistry of nucleic acids and related model compounds
Jean Cadet
Biochimie, 1985
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Vibrational Feshbach resonances in uracil and thymine
P. Burrow, Adam Scheer
The Journal of Chemical Physics, 2006
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Geometrical and Vibrational Properties of Nucleic Acid Constituents Interacting with Explicit Water Molecules as Analyzed by Density Functional Theory Calculations. 1. Uracil + n w H 2 O ( n w = 1,...,7)
Mahmoud Ghomi
The Journal of Physical Chemistry B, 2001
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Local Excitation of the 5-Bromouracil Chromophore in DNA. Computational and UV Spectroscopic Studies
Piotr Storoniak
The Journal of Physical Chemistry B, 2011
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Excited State Deactivation Mechanism in Protonated Uracil: New Insights from Theoretical Studies
fatemeh abedini
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Phototautomerism of the GC base pair of DNA
Punya Mishra
Journal of Theoretical Biology, 1981
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Structure and tautomeric properties of thymine derivatives generated by hydroxyl radical in aerobic conditions
Piotr Cysewski
Journal of the Chemical Society, Faraday Transactions, 1998
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Quantum Chemical predictions of the vibrational spectra of polyatomic molecules. The uracil molecule and two derivatives
MAURICIO ALCOLEA PALAFOX
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A note on a non-empirical molecular orbital study of some cytosine and thymine tautomers
Paul Mezey
Theoretica Chimica Acta, 1975
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Systematic quantum chemical study of DNA-base tautomers
Manuel Piacenza
Journal of Computational Chemistry, 2004
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C−H···O Contacts in the Adenine···Uracil Watson−Crick and Uracil···Uracil Nucleic Acid Base Pairs: Nonempirical ab Initio Study with Inclusion of Electron Correlation Effects
Modesto Orozco
The Journal of Physical Chemistry B, 2000
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Novel Tautomerisation Mechanisms of the Biologically Important Conformers of the Reverse Löwdin, Hoogsteen, and Reverse Hoogsteen G*·C* DNA Base Pairs via Proton Transfer: A Quantum-Mechanical Survey
Timothy Oliynyk
Frontiers in Chemistry
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