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.

Yevgen Yurenko

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Vibrational Spectroscopy: A tool for characterization of nucleic acid constituents: Cytosine and Uracil

MAURICIO ALCOLEA PALAFOX

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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 GC 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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