Publications

More filters

Results: 157

Paul W. Ayers, Ramon Carbó-Dorca
The relationship between the eigenvalues and eigenvectors of a similarity matrix and its associated Carbó index matrix
J Math Chem, 2011, 49, 6-11
DOI: 10.1007/s10910-010-9737-8
Keywords: Molecular similarity

Ramon Carbó-Dorca
Logical Kronecker delta deconstruction of the absolute value function and the treatment of absolute deviations
J Math Chem, 2011, 49, 619-624
DOI: 10.1007/s10910-010-9781-4
Keywords: Molecular similarity

Patrick Bultinck, Dorien Clarisse, Paul W. Ayers, Ramon Carbo-Dorca
The Fukui matrix: a simple approach to the analysis of the Fukui function and its positive character
Phys. Chem. Chem. Phys., 2011, 13, 6110-
DOI: 10.1039/C0CP02268C
Keywords: Molecular similarity

Ramon Carbó-Dorca
Definition of norm coherent generalized scalar products and quantum similarity
J Math Chem, 2010, 47, 331-344
DOI: 10.1007/s10910-009-9572-y
Keywords: Molecular similarity

Ramon Carbó-Dorca
A monodimensional scientific performance measure: the h index, can be substituted by simple multidimensional descriptors?
J Math Chem, 2010, 47, 548-550
DOI: 10.1007/s10910-009-9573-x
Keywords: Molecular similarity

Ramon Carbó-Dorca, Luz Dary Mercado
Commentaries on quantum similarity (1): Density gradient quantum similarity
J. Comput. Chem., 2010, 31, 2195-2212
DOI: 10.1002/jcc.21510
Keywords: Molecular similarity

Ramon Carbó-Dorca
LCAO MO first order density functions: Partition in monocentric and bicentric terms, reciprocal MO spaces, invariant transformations and Euclidian atomic populations
Journal of Molecular Structure: THEOCHEM, 2010, 943, 32-41
DOI: 10.1016/j.theochem.2009.09.025
Keywords: Molecular similarity

Ramon Carbó-Dorca, Ana Gallegos, Ángel J. Sánchez
Notes on quantitative structure-properties relationships (QSPR) (1): A discussion on a QSPR dimensionality paradox (QSPR DP) and its quantum resolution
J. Comput. Chem., 2009, 30, 1146-1159
DOI: 10.1002/jcc.21145
Keywords: Molecular similarity

Ramon Carbó-Dorca, AnaGallegos Saliner
Notes on quantitative structure-properties relationships (QSPR) part 2: The role of the number of atoms as a molecular descriptor
J. Comput. Chem., 2009, 30, 2099-2104
DOI: 10.1002/jcc.21208
Keywords: Molecular similarity

LLUÍS AMAT, RAMON CARBÓ-DORCA, DAVIDL. COOPER, NEILL. ALLAN, ROBERT PONEC
Structure—property relationships and momentum space quantities: Hammett σ—constants
Molecular Physics, 2009, 101, 3159-3162
DOI: 10.1080/00268970310001632499
Keywords: Molecular similarity