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Results: 1053

Ramon Carbó-Dorca, Emili Besalú, Luz Dary Mercado
Communications on quantum similarity, part 3: A geometric-quantum similarity molecular superposition algorithm
J. Comput. Chem., 2011, 32, 582-599
DOI: 10.1002/jcc.21644

H. Reis, O. Loboda, A. Avramopoulos, M.G. Papadopoulos, B. Kirtman, J.M. Luis, R. Zalesny
Electronic and vibrational linear and nonlinear polarizabilities of Li@C60 and [Li@C60]+
J. Comput. Chem., 2011, 32, 908-914
DOI: 10.1002/jcc.21674

Ramon Carbó-Dorca, Emili Besalú
Centroid origin shift of quantum object sets and molecular point clouds description and element comparisons
J. Math. Chem., 2011, 50, 1161-1178
DOI: 10.1007/s10910-011-9960-y

Emili Besalú, Ramon Carbó-Dorca
The general Gaussian product theorem
J. Math. Chem., 2011, 49, 1769-1784
DOI: 10.1007/s10910-011-9857-9

Ramon Carbó-Dorca, Emili Besalú
Shells, point cloud huts, generalized scalar products, cosines and similarity tensor representations in vector semispaces
J. Math. Chem., 2011, 50, 210-219
DOI: 10.1007/s10910-011-9906-4

Emili Besalú, Ramon Carbó-Dorca
n-Dimensional Euclidean space Gaussian enfoldment
J. Math. Chem., 2011, 49, 2231-2243
DOI: 10.1007/s10910-011-9882-8

Ramon Carbó-Dorca, Emili Besalú
Geometry of n-dimensional Euclidean space Gaussian enfoldments
J. Math. Chem., 2011, 49, 2244-2249
DOI: 10.1007/s10910-011-9883-7

Ramon Carbó-Dorca, Emili Besalú
On the nature of atomic shell approximation (ASA) electrostatic molecular potentials (EMP)
J. Math. Chem., 2011, 50, 981-988
DOI: 10.1007/s10910-011-9945-x

Halina Szatyłowicz, Tadeusz M. Krygowski, Marcin Palusiak, Jordi Poater, Miquel Solà
Routes of -Electron Delocalization in 4-Substituted-1,2-benzoquinones
J. Org. Chem., 2011, 76, 550-556
DOI: 10.1021/jo102065e

Majid El-Hamdi, William Tiznado, Jordi Poater, Miquel Solà
An Analysis of the Isomerization Energies of 1,2-/1,3-Diazacyclobutadiene, Pyrazole/Imidazole, and Pyridazine/Pyrimidine with the Turn-Upside-Down Approach
J. Org. Chem., 2011, 76, 8913-8921
DOI: 10.1021/jo201639k

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