Carbo-Dorca, R.: search on Z-Library

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1

Nine questions on energy decomposition analysis

Andrés, Juan, Ayers, Paul W., Boto, Roberto A., Carbó-Dorca, Ramon, Chermette, Henry, Cioslowski, Jerzy, Contreras-García, Julia, Cooper, David L., Frenking, Gernot, Gatti, Carlo, Heidar-Zadeh, Farnaz

Journal:

Journal of Computational Chemistry

Year:

2019

Language:

english

File:

PDF, 2.97 MB

english, 2019

2

A study on Goldbach conjecture

Carbó-Dorca, Ramon

Journal:

Journal of Mathematical Chemistry

Year:

2016

Language:

english

File:

PDF, 407 KB

english, 2016

3

Modeling the structure-property relationships of nanoneedles: A journey toward nanomedicine

Albert Poater, Ana Gallegos Saliner, Ramon Carbó-Dorca, Jordi Poater, Miquel Solà, Luigi Cavallo, Andrew P. Worth

Journal:

Journal of Computational Chemistry

Year:

2009

Language:

english

File:

PDF, 679 KB

english, 2009

4

On Einstein–Podolsky–Rosen Paradox

Ramon Carbó-Dorca

Journal:

Journal of Mathematical Chemistry

Year:

2007

Language:

english

File:

PDF, 91 KB

english, 2007

5

Refinement of a generalized Fermat’s last theorem conjecture in natural vector spaces

Carbó-Dorca, Ramon, Muñoz-Caro, Camelia, Niño, Alfonso, Reyes, Sebastián

Journal:

Journal of Mathematical Chemistry

Year:

2017

Language:

english

File:

PDF, 405 KB

english, 2017

6

A theorem on the Gram matrix of a polyhedron

Carbó-Dorca, Ramon

Journal:

Journal of Mathematical Chemistry

Year:

2017

Language:

english

File:

PDF, 467 KB

english, 2017

7

Coulomb repulsion, point-like nuclear charges, Dirac paradox, soft nuclear charge density and hypermultiplet nuclear repulsion

Carbó-Dorca, Ramon

Journal:

Journal of Mathematical Chemistry

Year:

2015

Language:

english

File:

PDF, 181 KB

english, 2015

8

N-dimensional Boolean hypercubes and the goldbach conjecture

Carbó-Dorca, Ramon

Journal:

Journal of Mathematical Chemistry

Year:

2016

Language:

english

File:

PDF, 378 KB

english, 2016

9

Fast Calculation of Quantum Chemical Molecular Descriptors from the Electronegativity Equalization Method

Bultinck, P., Langenaeker, W., Carbo-Dorca, R., Tollenaere, J.P.

Journal:

Journal of Chemical Information and Modeling

Year:

2003

Language:

english

File:

PDF, 58 KB

english, 2003

10

Quantum mechanical origin of QSAR: theory and applications

R. Carbó-Dorca, L. Amat, E. Besalú, X. Gironés, D. Robert

Journal:

Journal of Molecular Structure: THEOCHEM

Year:

2000

Language:

english

File:

PDF, 810 KB

english, 2000

11

Cantor-like transfinite sequences and Gödel-like incompleteness revealed by means of Mersenne transfinite dimensional boolean hypercube concatenation

Carbó-Dorca, Ramon

Journal:

Journal of Mathematical Chemistry

Year:

2019

Language:

english

File:

PDF, 735 KB

english, 2019

12

Notes on quantitative structure-properties relationships (QSPR) (1): A discussion on a QSPR dimensionality paradox (QSPR DP) and its quantum resolution

Ramon Carbó-Dorca, Ana Gallegos, Ángel J. Sánchez

Journal:

Journal of Computational Chemistry

Year:

2009

Language:

english

File:

PDF, 247 KB

english, 2009

13

Hypercubes defined on n-ary sets, the Erdös–Faber–Lovász conjecture on graph coloring, and the description spaces of polypeptides and RNA

Carbó-Dorca, Ramon, Chakraborty, Tanmoy

Journal:

Journal of Mathematical Chemistry

Year:

2019

Language:

english

File:

PDF, 1004 KB

english, 2019

14

Rayleigh-Schrödinger Perturbation Theory in Matrix Form

Besalú, Emili, Carbó-Dorca, Ramon

Journal:

Journal of Chemical Education

Year:

1998

Language:

english

File:

PDF, 175 KB

english, 1998

15

Using Molecular Quantum Similarity Measures under Stochastic Transformation To Describe Physical Properties of Molecular Systems

Girones, X., Carbo-Dorca, R.

Journal:

Journal of Chemical Information and Modeling

Year:

2002

Language:

english

File:

PDF, 85 KB

english, 2002

16

Notes on quantitative structure-properties relationships (QSPR) part 2: The role of the number of atoms as a molecular descriptor

Ramon Carbó-Dorca, Ana Gallegos Saliner

Journal:

Journal of Computational Chemistry

Year:

2009

Language:

english

File:

PDF, 91 KB

english, 2009

17

Quantum Mechanical Basis for Mulliken Population Analysis

Ramon Carbó-Dorca, Patrick Bultinck

Journal:

Journal of Mathematical Chemistry

Year:

2004

Language:

english

File:

PDF, 74 KB

english, 2004

18

Definition of norm coherent generalized scalar products and quantum similarity

Ramon Carbó-Dorca

Journal:

Journal of Mathematical Chemistry

Year:

2010

Language:

english

File:

PDF, 162 KB

english, 2010

19

Modeling Large Macromolecular Structures Using Promolecular Densities

Girones, X., Amat, L., Carbo-Dorca, R.

Journal:

Journal of Chemical Information and Modeling

Year:

2002

Language:

english

File:

PDF, 188 KB

english, 2002

20

[Advances in Quantum Chemistry] Volume 38 || Extended density functions

Carbó-Dorca, Ramon

Year:

2000

Language:

english

File:

PDF, 5.38 MB

english, 2000

21

Role of the structure of Boolean hypercubes when used as vectors in natural (Boolean) vector semispaces

Carbó-Dorca, Ramon

Journal:

Journal of Mathematical Chemistry

Year:

2019

Language:

english

File:

PDF, 355 KB

english, 2019

22

Chemical bonds from the condition of minimal pair fluctuation: Correlated case

Robert Ponec, Ramon Carbó-Dorca

Journal:

International Journal of Quantum Chemistry

Year:

1999

Language:

english

File:

PDF, 149 KB

english, 1999

23

Communications on quantum similarity, part 3: A geometric-quantum similarity molecular superposition algorithm

Ramon Carbó-Dorca, Emili Besalú, Luz Dary Mercado

Journal:

Journal of Computational Chemistry

Year:

2011

Language:

english

File:

PDF, 298 KB

english, 2011

24

A monodimensional scientific performance measure: thehindex, can be substituted by simple multidimensional descriptors?

Ramon Carbó-Dorca

Journal:

Journal of Mathematical Chemistry

Year:

2010

Language:

english

File:

PDF, 86 KB

english, 2010

25

Quantum similarity, volume functions and generalized Carbó indices

Ramon Carbó-Dorca

Journal:

Journal of Mathematical Chemistry

Year:

2011

Language:

english

File:

PDF, 116 KB

english, 2011

26

Generalized one-electron spin functions and self-similarity measures

E. Besalú, R. Carbó-Dorca, J. Karwowski

Journal:

Journal of Mathematical Chemistry

Year:

2001

Language:

english

File:

PDF, 61 KB

english, 2001

27

Inward matrix products: extensions and applications to quantum mechanical foundations of QSAR

R. Carbó-Dorca

Journal:

Journal of Molecular Structure: THEOCHEM

Year:

2001

Language:

english

File:

PDF, 166 KB

english, 2001

28

Construction of coherent nano quantitative structure–properties relationships (nano-QSPR) models and catastrophe theory

Carbó-Dorca, R., Besalú, E.

Journal:

SAR and QSAR in Environmental Research

Year:

2011

Language:

english

File:

PDF, 103 KB

english, 2011

29

Softened electrostatic molecular potentials

Besalú, Emili, Carbó-Dorca, Ramon

Journal:

Journal of Molecular Graphics and Modelling

Year:

2013

Language:

english

File:

PDF, 3.01 MB

english, 2013

30

Molecular Quantum Similarity Analysis of Estrogenic Activity

GallegosSaliner, A., Amat, L., Carbo-Dorca, R., Schultz, T.W., Cronin, M.T.D.

Journal:

Journal of Chemical Information and Modeling

Year:

2003

Language:

english

File:

PDF, 180 KB

english, 2003

31

Least squares estimation of unknown molecular properties and quantum QSPR fundamental equation

Carbó-Dorca, Ramon

Journal:

Journal of Mathematical Chemistry

Year:

2015

Language:

english

File:

PDF, 344 KB

english, 2015

32

ChemInform Abstract: Modeling Antimalarial Activity: Application of Kinetic Energy Density Quantum Similarity Measures as Descriptors in QSAR.

Xavier Girones, Ana Gallegos, Ramon Carbo-Dorca

Journal:

Year:

2001

File:

PDF, 24 KB

2001

33

Maximal probability domains in linear molecules

A. Gallegos, R. Carbó-Dorca, F. Lodier, E. Cancès, A. Savin

Journal:

Journal of Computational Chemistry

Year:

2005

Language:

english

File:

PDF, 142 KB

english, 2005

34

Application of Molecular Quantum Similarity to QSAR

Xavier Fradera, Lluís Amat, Emili Besalü, Ramon Carbó-Dorca

Journal:

Molecular Informatics

Year:

1997

Language:

english

File:

PDF, 630 KB

english, 1997

35

Quantum chemistry, Sobolev spaces and SCF

Albert Bach, Lluis Amat, Emili Besalú, Ramon Carbó-Dorca, Robert Ponec

Journal:

Journal of Mathematical Chemistry

Year:

2000

Language:

english

File:

PDF, 127 KB

english, 2000

36

Molecular Electronic Density Fitting Using Elementary Jacobi Rotations under Atomic Shell Approximation

Amat, L., Carbo-Dorca, R.

Journal:

Journal of Chemical Information and Modeling

Year:

2000

Language:

english

File:

PDF, 173 KB

english, 2000

37

Solutions to the Quantum QSPR problem in molecular spaces

Ramon Carbó-Dorca, Sofie Van Damme

Journal:

Theoretical Chemistry Accounts: Theory, Computation, and Modeling (Theoretica Chimica Acta)

Year:

2007

Language:

english

File:

PDF, 146 KB

english, 2007

38

Mathematical aspects of the LCAO MO first order density function (3): A general localization procedure

Ramon Carbó-Dorca, Patrick Bultinck

Journal:

Journal of Mathematical Chemistry

Year:

2008

Language:

english

File:

PDF, 83 KB

english, 2008

39

Molecular Nuclear Fields: A Naïve Perspective

Ramon Carbó-Dorca

Journal:

Journal of Mathematical Chemistry

Year:

2005

Language:

english

File:

PDF, 69 KB

english, 2005

40

Facet diagrams for quantum similarity data

David Robert, Xavier Gironés, Ramon Carbó-Dorca

Journal:

Journal of Computer-Aided Molecular Design

Year:

1999

Language:

english

File:

PDF, 165 KB

english, 1999

41

On the nature of atomic shell approximation (ASA) electrostatic molecular potentials (EMP)

Ramon Carbó-Dorca, Emili Besalú

Journal:

Journal of Mathematical Chemistry

Year:

2012

Language:

english

File:

PDF, 196 KB

english, 2012

42

[Mathematical and Computational Chemistry] Fundamentals of Molecular Similarity || Quantum-Mechanical Theory of Atoms in Molecules: A Relativistic Formulation

Carbó-Dorca, Ramon, Gironés, Xavier, Mezey, Paul G.

Year:

2001

Language:

english

File:

PDF, 800 KB

english, 2001

43

Three-Dimensional Quantitative Structure-Activity Relationships from Tuned Molecular Quantum Similarity Measures: Prediction of the Corticosteroid-Binding Globulin Binding Affinity for a Steroid Family

Robert, D., Amat, L., Carbo-Dorca, R.

Journal:

Journal of Chemical Information and Modeling

Year:

1999

Language:

english

File:

PDF, 110 KB

english, 1999

44

Molecular Quantum Similarity Measures as Descriptors for Quantum QSAR

Robert, David, Gironés, Xavier, Carbó-Dorca, Ramon

Journal:

Polycyclic Aromatic Compounds

Year:

2001

Language:

english

File:

PDF, 715 KB

english, 2001

45

Unrevealed structural requirements for auxin-like molecules by theoretical and experimental evidences

Noel Ferro, Patrick Bultinck, Ana Gallegos, Hans-Jörg Jacobsen, Ramon Carbo-Dorca, Thomas Reinard

Journal:

Year:

2007

Language:

english

File:

PDF, 712 KB

english, 2007

46

Mathematical aspects of the LCAO MO first order density function (4): a discussion on the connection of Taylor series expansion of electronic density (TSED) function with the holographic electron density theorem (HEDT) and the Hohenberg-Kohn theorem (HKT)

R. Carbó-Dorca, E. Besalú

Journal:

Journal of Mathematical Chemistry

Year:

2011

Language:

english

File:

PDF, 129 KB

english, 2011

47

Shells, point cloud huts, generalized scalar products, cosines and similarity tensor representations in vector semispaces

Ramon Carbó-Dorca, Emili Besalú

Journal:

Journal of Mathematical Chemistry

Year:

2012

Language:

english

File:

PDF, 155 KB

english, 2012

48

Structure-toxicity relationships of polycyclic aromatic hydrocarbons using molecular quantum similarity

Ana Gallegos, David Robert, Xavier Gironés, Ramon Carbó-Dorca

Journal:

Journal of Computer-Aided Molecular Design

Year:

2001

Language:

english

File:

PDF, 115 KB

english, 2001

49

An isometric representation problem in quantum multimolecular polyhedra and similarity: (2) synisometry

Carbó-Dorca, Ramon

Journal:

Journal of Mathematical Chemistry

Year:

2015

Language:

english

File:

PDF, 375 KB

english, 2015

50

Chemical structures from the analysis of domain-averaged Fermi holes: Multiple metalmetal bonding in transition metal compounds

Robert Ponec, Gleb Yuzhakov, Ramon Carbó-Dorca

Journal:

Journal of Computational Chemistry

Year:

2003

Language:

english

File:

PDF, 357 KB

english, 2003

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