Results: 173
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-xKeywords: 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.21510Keywords: 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.2009.09.025Keywords: 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.21145Keywords: 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.21208Keywords: 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: 10.1080/00268970310001632499Keywords: Molecular similarity
Ramon Carbó-Dorca, Sofie Van Damme
A new insight on the quantum quantitative structure-properties relationships
Int. J. Quantum Chem., 2008, 108, 1721-1734
DOI: 10.1002/qua.21703Keywords: Molecular similarity
Ramon Carbó-Dorca, Patrick Bultinck
Mathematical aspects of the LCAO MO first order density function (3): A general localization procedure
J Math Chem, 2008, 43, 1069-1075
DOI: 10.1007/s10910-007-9242-xKeywords: Molecular similarity
Ramon Carbó-Dorca
Mathematical aspects of the LCAO MO first order density function (1): atomic partition, metric structure and practical applications
J Math Chem, 2008, 43, 1076-1101
DOI: 10.1007/s10910-007-9244-8Keywords: Molecular similarity
Ramon Carbó-Dorca
Mathematical aspects of the LCAO MO first order density function (2): Relationships between density functions
J Math Chem, 2008, 43, 1102-1118
DOI: 10.1007/s10910-007-9245-7Keywords: Molecular similarity