Sidi Mohamed Mekelleche, Pr.
Sidi Mohamed Mekelleche, Pr.
Department of Chemistry, Faculty of Science, University of Tlemcen, ALGERIA
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2-Mercapto-1-methylimidazole as corrosion inhibitor for copper in hydrochloric acid
L Larabi, O Benali, SM Mekelleche, Y Harek
Applied Surface Science 253 (3), 1371-1378, 2006
Understanding the kinetic solvent effects on the 1, 3‐dipolar cycloaddition of benzonitrile N‐oxide: a DFT study
W Benchouk, SM Mekelleche, B Silvi, MJ Aurell, LR Domingo
Journal of Physical Organic Chemistry 24 (7), 611-618, 2011
Influence of substitution of phenyl group by naphthyl in a diphenylthiourea molecule on corrosion inhibition of cold-rolled steel in 0.5 M H2SO4
O Benali, L Larabi, SM Mekelleche, Y Harek
Journal of materials science 41, 7064-7073, 2006
Understanding the mechanism of the Povarov reaction. A DFT study
LR Domingo, MJ Aurell, JA Sáez, SM Mekelleche
RSC Advances 4 (48), 25268-25278, 2014
Correlation of aqueous pKa values of carbon acids with theoretical descriptors: A DFT study
IE Charif, SM Mekelleche, D Villemin, N Mora-Diez
Journal of Molecular Structure: THEOCHEM 818 (1-3), 1-6, 2007
Unified analytical treatment of one-electron two-center integrals with noninteger n Slater-type orbitals
SM Mekelleche, A Baba-Ahmed
Theoretical Chemistry Accounts 103, 463-468, 2000
Calculation of the one‐electron two‐center integrals over Slater‐type orbitals by means of the ellipsoidal coordinates method
SM Mekelleche, A Baba‐Ahmed
International journal of quantum chemistry 63 (4), 843-852, 1997
Understanding the role of the Lewis acid catalyst on the 1, 3-dipolar cycloaddition of N-benzylideneaniline N-oxide with acrolein: a DFT study
LR Domingo, W Benchouk, SM Mekelleche
Tetrahedron 63 (21), 4464-4471, 2007
Understanding the regio-and chemoselective polar [3+ 2] cycloaddition of the Padwa carbonyl ylides with α-methylene ketones. A DFT study
W Benchouk, SM Mekelleche, MJ Aurell, LR Domingo
Tetrahedron 65 (24), 4644-4651, 2009
Theoretical analysis of the regioselectivity of 1, 3-dipolar cycloaddition of C-(methoxycarbonyl)-N-methyl with methyl acrylate and vinyl acetate
W Benchouk, SM Mekelleche
Journal of Molecular Structure: THEOCHEM 852 (1-3), 46-53, 2008
Prediction of the melting points of fatty acids from computed molecular descriptors: A quantitative structure–property relationship study
A Guendouzi, SM Mekelleche
Chemistry and physics of lipids 165 (1), 1-6, 2012
Theoretical study of the mechanism and regioselectivity of the 1, 3-dipolar cycloaddition of diazomethane with methyl acrylate using theoretical approaches
W Benchouk, SM Mekelleche
Journal of Molecular Structure: THEOCHEM 862 (1-3), 1-6, 2008
QSAR study of the toxicity of nitrobenzenes to Tetrahymena pyriformis using quantum chemical descriptors
K Bellifa, SM Mekelleche
Arabian Journal of Chemistry 9, S1683-S1689, 2016
Reactivity and regioselectivity of five-membered heterocycles in electrophilic aromatic substitution: A theoretical investigation
A Ghomri, SM Mekelleche
Journal of Molecular Structure: THEOCHEM 941 (1-3), 36-40, 2010
Computational study of linear and nonlinear optical properties of substituted thiophene imino dyes using long-range corrected hybrid DFT methods
L Kara Zaitri, SM Mekelleche
Molecular Physics 118 (4), 1618508, 2020
Density functional theory study of the regio‐and stereoselectivity of diels–alder reactions of 5‐Aryl‐2‐pyrones
H Chemouri, SM Mekelleche
International Journal of Quantum Chemistry 112 (10), 2294-2300, 2012
Solvent effects on the keto-enol tautomeric equilibrium of tetronic and ethyl acetoacetate carbon acids: a theoretical study
IE Charif, SM Mekelleche, D Villemin
Journal of Theoretical and Computational Chemistry 9 (06), 1021-1032, 2010
Quantitative conformational stability host-guest complex of Carvacrol and Thymol with β-cyclodextrin: a theoretical investigation
A Guendouzi, SM Mekelleche, H Brahim, K Litim
Journal of Inclusion Phenomena and Macrocyclic Chemistry 89, 143-155, 2017
Prediction of the reactivity of 2 (5H)-furanones as potential dienophiles in Diels–Alder reactions using philicity indexes
A Benmeddah, SM Mekelleche, W Benchouk, B Mostefa-Kara, D Villemin
Journal of Molecular Structure: THEOCHEM 821 (1-3), 42-46, 2007
Nonlinear optical activity of imino-dyes with furan, thiophene or thiazole moieties as π-conjugated bridge: a computational investigation
L Kara Zaitri, SM Mekelleche
Molecular Physics 118 (18), e1761471, 2020
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