Similarity ideas in the theory of pericyclic reactivity. - Robert Ponec; Martin Strnad (J. Chem. Inf. Comput. Sci., 1992)

Similarity approach to chemical reactivity. A simple criterion for discriminating between one-step and stepwise reaction mechanisms in pericyclic reactivity. - Robert Ponec (J. Chem. Inf. Comput. Sci., 1993)

Similarity Approach to Chemical Reactivity. Overlap Determinant Method in the Chemistry of Complex Reactions with Coarctate Transition States. - Robert Ponec (J. Chem. Inf. Comput. Sci., 1996)

Similarity Approach to Chemical Reactivity. Regioselectivity in Pericyclic Reactions. - Robert Ponec (J. Chem. Inf. Comput. Sci., 1997)

Molecular quantum similarity measures as an alternative to log P values in QSAR studies. - Lluís Amat; Ramon Carbó-Dorca; Robert Ponec (J. Comput. Chem., 1998)

Molecular basis of quantitative structure-properties relationships (QSPR): A quantum similarity approach. - Robert Ponec; Lluís Amat; Ramon Carbó-Dorca (J. Comput. Aided Mol. Des., 1999)

Electron pairing and chemical bonds: Bonding in hypervalent molecules from analysis of Fermi holes. - Robert Ponec; Anthony J. Duben (J. Comput. Chem., 1999)

Nature of nonclassical bonds in Closo-Boranes: Nonlinear population analysis approach. - Alícia Torre; Luis Lain; Roberto C. Bochicchio; Robert Ponec (J. Comput. Chem., 1999)

Identification of Active Molecular Sites Using Quantum-Self-Similarity Measures. - Lluís Amat; Emili Besalú; Ramon Carbó-Dorca; Robert Ponec (J. Chem. Inf. Comput. Sci., 2001)

Molecular Basis of Linear Free Energy Relationships. The Nature of Inductive Effect in Aliphatic Series. - Robert Ponec; Xavier Gironés; Ramon Carbó-Dorca (J. Chem. Inf. Comput. Sci., 2002)

Chemical structures from the analysis of domain-averaged Fermi holes: Multiple metalmetal bonding in transition metal compounds. - Robert Ponec; Gleb Yuzhakov; Ramon Carbó-Dorca (J. Comput. Chem., 2003)

Molecular Basis of LFER. Modeling of the Electronic Substituent Effect Using Fragment Quantum Self-Similarity Measures. - Xavier Gironés; Ramon Carbó-Dorca; Robert Ponec (J. Chem. Inf. Comput. Sci., 2003)

Electron pairing and chemical bonds. Electron fluctuation and pair localization in ELF domains. - Robert Ponec; Joaquin Chaves (J. Comput. Chem., 2005)

Chemical structures from the analysis of domain-averaged fermi holes. Nature of the Mn-Mn bond in bis(pentacarbonylmanganese). - Robert Ponec; Gleb Yuzhakov; Markku R. Sundberg (J. Comput. Chem., 2005)

Molecular Quantum Similarity Measures from Fermi Hole Densities: Modeling Hammett Sigma Constants. - Xavier Gironés; Robert Ponec (J. Chem. Inf. Model., 2006)

Aromaticity in linear polyacenes: Generalized population analysis and molecular quantum similarity approach. - Patrick Bultinck; Robert Ponec; Ramon Carbó-Dorca (J. Comput. Chem., 2007)

Electron pairing and chemical bonds: Pair localization in ELF domains from the analysis of domain averaged Fermi holes. - Robert Ponec; Joaquin Chaves (J. Comput. Chem., 2007)

Structure and bonding in binuclear metal carbonyls from the analysis of domain averaged Fermi holes. I. Fe2(CO)9 and Co2(CO)8. - Robert Ponec; György Lendvay; Joaquin Chaves (J. Comput. Chem., 2008)

Bond indices in solids: Extended analytical model. - Robert Ponec (J. Comput. Chem., 2011)