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2010 – 2019
- 2011
[j19]Robert Ponec:
Bond indices in solids: Extended analytical model. J. Comput. Chem. 32(14): 3114-3121 (2011)
2000 – 2009
- 2008
- [j18]Robert Ponec, György Lendvay
, Joaquin Chaves:
Structure and bonding in binuclear metal carbonyls from the analysis of domain averaged Fermi holes. I. Fe2(CO)9 and Co2(CO)8. J. Comput. Chem. 29(9): 1387-1398 (2008) - 2007
- [j17]Robert Ponec, Joaquin Chaves:
Electron pairing and chemical bonds: Pair localization in ELF domains from the analysis of domain averaged Fermi holes. J. Comput. Chem. 28(1): 109-116 (2007) - [j16]Patrick Bultinck, Robert Ponec, Ramon Carbó-Dorca:
Aromaticity in linear polyacenes: Generalized population analysis and molecular quantum similarity approach. J. Comput. Chem. 28(1): 152-160 (2007) - 2006
- [j15]Xavier Gironés, Robert Ponec:
Molecular Quantum Similarity Measures from Fermi Hole Densities: Modeling Hammett Sigma Constants. J. Chem. Inf. Model. 46(3): 1388-1393 (2006) - 2005
- [j14]Robert Ponec, Gleb Yuzhakov, Markku R. Sundberg:
Chemical structures from the analysis of domain-averaged fermi holes. Nature of the Mn-Mn bond in bis(pentacarbonylmanganese). J. Comput. Chem. 26(5): 447-454 (2005) - [j13]Robert Ponec, Joaquin Chaves:
Electron pairing and chemical bonds. Electron fluctuation and pair localization in ELF domains. J. Comput. Chem. 26(12): 1205-1213 (2005) - 2003
- [j12]Robert Ponec, Gleb Yuzhakov, Ramon Carbó-Dorca:
Chemical structures from the analysis of domain-averaged Fermi holes: Multiple metalmetal bonding in transition metal compounds. J. Comput. Chem. 24(15): 1829-1838 (2003) - [j11]Xavier Gironés, Ramon Carbó-Dorca, Robert Ponec:
Molecular Basis of LFER. Modeling of the Electronic Substituent Effect Using Fragment Quantum Self-Similarity Measures. J. Chem. Inf. Comput. Sci. 43(6): 2033-2038 (2003) - 2002
- [j10]Robert Ponec, Xavier Gironés, Ramon Carbó-Dorca:
Molecular Basis of Linear Free Energy Relationships. The Nature of Inductive Effect in Aliphatic Series. J. Chem. Inf. Comput. Sci. 42(3): 564-570 (2002) - 2001
- [j9]Lluís Amat, Emili Besalú, Ramon Carbó-Dorca, Robert Ponec:
Identification of Active Molecular Sites Using Quantum-Self-Similarity Measures. J. Chem. Inf. Comput. Sci. 41(4): 978-991 (2001)
1990 – 1999
- 1999
- [j8]Robert Ponec, Lluís Amat, Ramon Carbó-Dorca:
Molecular basis of quantitative structure-properties relationships (QSPR): A quantum similarity approach. J. Comput. Aided Mol. Des. 13(3): 259-270 (1999) - [j7]Robert Ponec, Anthony J. Duben:
Electron pairing and chemical bonds: Bonding in hypervalent molecules from analysis of Fermi holes. J. Comput. Chem. 20(8): 760-771 (1999) - [j6]Alícia Torre, Luis Lain, Roberto C. Bochicchio, Robert Ponec:
Nature of nonclassical bonds in Closo-Boranes: Nonlinear population analysis approach. J. Comput. Chem. 20(10): 1085-1090 (1999) - 1998
- [j5]Lluís Amat, Ramon Carbó-Dorca, Robert Ponec:
Molecular quantum similarity measures as an alternative to log P values in QSAR studies. J. Comput. Chem. 19(14): 1575-1583 (1998) - 1997
- [j4]Robert Ponec:
Similarity Approach to Chemical Reactivity. Regioselectivity in Pericyclic Reactions. J. Chem. Inf. Comput. Sci. 37(4): 745-751 (1997) - 1996
- [j3]Robert Ponec:
Similarity Approach to Chemical Reactivity. Overlap Determinant Method in the Chemistry of Complex Reactions with Coarctate Transition States. J. Chem. Inf. Comput. Sci. 36(3): 554-558 (1996) - 1993
- [j2]Robert Ponec:
Similarity approach to chemical reactivity. A simple criterion for discriminating between one-step and stepwise reaction mechanisms in pericyclic reactivity. J. Chem. Inf. Comput. Sci. 33(6): 805-811 (1993) - 1992
- [j1]Robert Ponec, Martin Strnad:
Similarity ideas in the theory of pericyclic reactivity. J. Chem. Inf. Comput. Sci. 32(6): 693-699 (1992)
Coauthor Index
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