Publications
List of Scientific Publications
Total number of publications: 161
2008
Molecular quantum similarity measures in Minkowski metric vector semispaces
Journal of Mathematical Chemistry, 2008, 44, 3, 628-636
DOI: 10.1007/s10910-008-9442-z
Diagonal coefficient representation of density functions and quantum similarity measures
Journal of Mathematical Chemistry, 2008, 44, 3, 621-627
DOI: 10.1007/s10910-008-9441-0
A new insight on the quantum quantitative structure‐properties relationships
International Journal of Quantum Chemistry, 2008, 108, 10, 1721-1734
DOI: 10.1002/qua.21703
2007
Solutions to the Quantum QSPR problem in molecular spaces
Theoretical Chemistry Accounts, 2007, 118, 3, 673-679
DOI: 10.1007/s00214-007-0352-0
Critical thoughts on computing atom condensed Fukui functions
The Journal of Chemical Physics, 2007, 127, 3
DOI: 10.1063/1.2749518
Critical analysis and extension of the Hirshfeld atoms in molecules
The Journal of Chemical Physics, 2007, 126, 14
DOI: 10.1063/1.2715563
Comment on “Chemoselectives in Acetalization, Thioacetalization, Oxathioacetalization and Azathioacetalization”
The Journal of Physical Chemistry A, 2007, 111, 13, 2640-2640
DOI: 10.1021/jp067333o
On Einstein–Podolsky–Rosen Paradox
Journal of Mathematical Chemistry, 2007, 41, 3, 209-215
DOI: 10.1007/s10910-006-9054-4
Aromaticity in linear polyacenes: Generalized population analysis and molecular quantum similarity approach
Journal of Computational Chemistry, 2007, 28, 1, 152-160
DOI: 10.1002/jcc.20491
Unrevealed structural requirements for auxin-like molecules by theoretical and experimental evidences
Phytochemistry, 2007, 68, 2, 237-250
DOI: 10.1016/j.phytochem.2006.10.006
2006
Toward an Alternative Hardness Kernel Matrix Structure in the Electronegativity Equalization Method (EEM)
Journal of Chemical Information and Modeling, 2006, 46, 4, 1657-1665
DOI: 10.1021/ci050505e
Coulomb and Overlap Self-Similarities: A Comparative Selectivity Analysis of Structure−Function Relationships for Auxin−like Molecules
Journal of Chemical Information and Modeling, 2006, 46, 4, 1751-1762
DOI: 10.1021/ci050491c
Modelling Toxicity using Molecular Quantum Similarity Measures
QSAR & Combinatorial Science, 2006, 25, 7, 579-589
Electron Delocalization and Aromaticity in Linear Polyacenes: Atoms in Molecules Multicenter Delocalization Index
The Journal of Physical Chemistry A, 2006, 110, 24, 7642-7648
DOI: 10.1021/jp0609176
Descriptors and Probability Distributions in MO Theory: Weighted Mulliken Matrices and Molecular Quantum Similarity Measures
Journal of Mathematical Chemistry, 2006, 39, 3-4, 551-591
DOI: 10.1007/s10910-005-9049-6
Generation of Molecular Fields, Quantum Similarity Measures and Related Questions
Journal of Mathematical Chemistry, 2006, 39, 3-4, 495-510
DOI: 10.1007/s10910-005-9046-9
A Discussion on the Einstein–Podolski–Rosen (EPR) Effect* in a Unique Wavefunction Quantum Mechanical Framework
Journal of Mathematical Chemistry, 2006, 39, 2, 267-279
DOI: 10.1007/s10910-005-9031-3
2005
Deduction of Heisenberg relations and Schrödinger equation through the structure of N -dimensional parameterized metric vector spaces
Journal of Mathematical Chemistry, 2005, 38, 1, 89-101
DOI: 10.1007/s10910-005-4531-8
Geometric and electronic similarities between transition structures for electrocyclizations and sigmatropic hydrogen shifts
Theoretical Chemistry Accounts, 2005, 113, 4, 205-211
DOI: 10.1007/s00214-004-0625-9
Maximal probability domains in linear molecules
Journal of Computational Chemistry, 2005, 26, 5, 455-460
DOI: 10.1002/jcc.20180