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http://hub.abes.fr/acs/periodical/joceah/1989/volume_54/issue_10/101021jo00271a056/authorship/1
http://hub.abes.fr/acs/periodical/jpchax/1992/volume_96/issue_5/101021j100184a020/authorship/1
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http://hub.abes.fr/acs/periodical/orgnd7/1989/volume_8/issue_8/101021om00110a001/authorship/1
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Theoretical study of the bonding of the first-row transition-metal positive ions to ethylene
Theoretical Study of the Ionization of the H2S-H2S, PH3-H2S, and ClH-H2S Hydrogen Bonded Molecules
Theoretical study of the bonding of the first- and second-row transition-metal positive ions to acetylene
Diels-Alder cycloadditions of electron-rich, electron-deficient, and push-pull dienes with cyclic dienophiles: high-pressure-induced reactions and theoretical calculations
Theoretical study of the alkaline-earth metal superoxides BeO2 through SrO2
Theoretical Study of the Structure of ZCu(NO2)(NO). A Proposed Intermediate in the NOxDecomposition by Cu−ZSM-5
Ground and Low-Lying States of Cu2+−H2O. A Difficult Case for Density FunctionalMethods
Interaction of Co+ and Co2+ with Glycine. A Theoretical Study
Binding Properties of Cu+/2+-(glycyl)nglycine Complexes (n = 1−3)
On the NO Decomposition by Cu−ZSM-5 through the ZCu(NO2)(NO) or ZCu(N2O3)Intermediates
Hydrogen Bond vs Proton Transfer in HZSM5 Zeolite. A Theoretical Study
Hydrogen Atom or Proton Transfer in Neutral and Single PositiveIons of Salicylic Acid and Related Compounds
Aluminosilicate Surfaces as Promoters for Peptide BondFormation: An Assessment of Bernal's Hypothesis byab Initio Methods
Theoretical Study of M+−CO2 and OM+CO Systems for First Transition Row Metal Atoms
Interaction of Glycine with Isolated Hydroxyl Groups at the SilicaSurface: First Principles B3LYP Periodic Simulation
A Theoretical Study of the Endo/Exo Selectivity of theDiels−Alder Reaction between Cyclopropene and Butadiene
Coordination of NO2 to Alkaline-Earth Metals. A Theoretical Study
Ground State of the (H2O)2+ Radical Cation: DFT versus Post-Hartree−Fock Methods
Intramolecular Proton Transfer in Glycine Radical Cation
Isomerization versus Fragmentation of Glycine Radical Cation in Gas Phase
Coordination of Cu+ Ions to Zeolite Frameworks Strongly EnhancesTheir Ability To Bind NO2. An ab Initio Density Functional Study
Theoretical Study of the Ionization of Phenol−Water and Phenol−AmmoniaHydrogen-Bonded Complexes
Coordination Properties of Lysine Interacting with Co(I) and Co(II). A Theoretical and Mass Spectrometry Study
Gas Phase Dissociation Energies of Saturated AHn·+ RadicalCations and AHn Neutrals (A = Li−F, Na−Cl): Dehydrogenation, Deprotonation, and Formation ofAHn-2·+ − H2 Complexes
Effect of Counterpoise Correction on the Geometries and Vibrational Frequencies ofHydrogen Bonded Systems
Gas Phase Reactivity of Ni+ with Urea. Mass Spectrometry and Theoretical Studies
A Quantum Chemical Study of Cu2+ Interacting with Guanine−Cytosine Base Pair.Electrostatic and Oxidative Effects on Intermolecular Proton-Transfer Processes
Coordination of NO2 to Cu and Mg in M(NO2)2 Complexes. A Theoretical Study
Gas-Phase Reactivity of Ni+ with Glycine
The Different Nature of Bonding in Cu+-Glycine and Cu2+-Glycine
Cation−π Interactions and Oxidative Effects on Cu+ and Cu2+ Binding to Phe, Tyr, Trp,and His Amino Acids in the Gas Phase. Insights from First-Principles Calculations
Is the Peptide Bond Formation Activated by Cu2+ Interactions? Insights from DensityFunctional Calculations
Palladium Nanoparticles Entrapped in Heavily FluorinatedCompounds
Single versus Double Proton-Transfer Reactions in Watson−CrickBase Pair Radical Cations. A Theoretical Study
Triplet (π,π*) Reactivity of the Guanine−Cytosine DNA Base Pair: BenignDeactivation versus Double Tautomerization via Intermolecular HydrogenTransfer
Keto−Enol Isomerization of Acetaldehyde in HZSM5. A Theoretical Study Using theONIOM2 Method
Can Cu+-Exchanged Zeolites Store Molecular Hydrogen? An Ab-Initio Periodic StudyCompared with Low-Temperature FTIR
Influence of N7 Protonation on the Mechanism of the N-Glycosidic Bond Hydrolysis in2‘-Deoxyguanosine. A Theoretical Study
On the Bonding of First-Row Transition Metal Cations to Guanine andAdenine Nucleobases
Adsorption of NH3 and H2O in Acidic Chabazite. Comparison of ONIOM Approach withPeriodic Calculations
Cu2+/+ Cation Coordination to Adenine−Thymine Base Pair. Effects on IntermolecularProton-Transfer Processes
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