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Results: 1059

Alexander A. Voityuk
Are Radical Cation States Delocalized over GG and GGG Hole Traps in DNA?
J. Phys. Chem. B, 2005, 109, 10793-10796
DOI: 10.1021/jp050985c

Alexander A. Voityuk
Electronic Couplings in DNA π-Stacks:  Multistate Effects
J. Phys. Chem. B, 2005, 109, 17917-17921
DOI: 10.1021/jp052783m

Eduard Matito, Miquel Solà, Miquel Duran, Jordi Poater
Comment on the Nature of Bonding in the Thermal Cyclization of (Z)-1,2,4,6-Heptatetraene and Its Heterosubstituted Analogues
J. Phys. Chem. B, 2005, 109, 7591-7593
DOI: 10.1021/jp048033e

Pau Nolis, Anna Roglans, Teodor Parella
IFSERF, an isotope-filtered SERF experiment for the precise measurement of proton–proton coupling constants between chemically equivalent protons
Journal of Magnetic Resonance, 2005, 173, 305-309
DOI: 10.1016/j.jmr.2004.11.029

Miquel Torrent-Sucarrat, Josep Maria Luis, Miquel Duran, Miquel Solà
An assessment of a simple hardness kernel approximation for the calculation of the global hardness in a series of Lewis acids and bases
Journal of Molecular Structure: THEOCHEM, 2005, 727, 139-148
DOI: 10.1016/j.theochem.2005.02.018

Eduard Matito, Jordi Poater, Miquel Duran, Miquel Solà
An analysis of the changes in aromaticity and planarity along the reaction path of the simplest DielsAlder reaction. Exploring the validity of different indicators of aromaticity
Journal of Molecular Structure: THEOCHEM, 2005, 727, 165-171
DOI: 10.1016/j.theochem.2005.02.020

J.M. Barroso, E. Besalú
Design of experiments applied to QSAR: ranking a set of compounds and establishing a statistical significance test
Journal of Molecular Structure: THEOCHEM, 2005, 727, 89-96
DOI: 10.1016/j.theochem.2005.02.051

Miquel Duran, Miquel Solà, Emili Besalú
Introduction
Journal of Molecular Structure: THEOCHEM, 2005, 727, XIII
DOI: 10.1016/j.theochem.2005.05.012

Judit Masllorens, Sandrine Bouquillon, Anna Roglans, Françoise Hénin, Jacques Muzart
The Heck-type arylation of allylic alcohols with arenediazonium salts
Journal of Organometallic Chemistry, 2005, 690, 3822-3826
DOI: 10.1016/j.jorganchem.2005.05.020

Gernot Frenking, Miquel Solà, Sergei F. Vyboishchikov
Chemical bonding in transition metal carbene complexes
Journal of Organometallic Chemistry, 2005, 690, 6178-6204
DOI: 10.1016/j.jorganchem.2005.08.054

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