| An overview of halogen bonding P Politzer, P Lane, MC Concha, Y Ma, JS Murray Journal of molecular modeling 13, 305-311, 2007 | 1505 | 2007 |
| An electrostatic interaction correction for improved crystal density prediction P Politzer, J Martinez, JS Murray, MC Concha, A Toro-Labbe Molecular Physics 107 (19), 2095-2101, 2009 | 437 | 2009 |
| σ-hole bonding between like atoms; a fallacy of atomic charges P Politzer, JS Murray, MC Concha Journal of molecular modeling 14, 659-665, 2008 | 415 | 2008 |
| Halogen bond tunability I: the effects of aromatic fluorine substitution on the strengths of halogen-bonding interactions involving chlorine, bromine, and iodine KE Riley, JS Murray, J Fanfrlík, J Řezáč, RJ Solá, MC Concha, FM Ramos, ... Journal of molecular modeling 17, 3309-3318, 2011 | 413 | 2011 |
| Halogen bonding and the design of new materials: organic bromides, chlorides and perhaps even fluorides as donors P Politzer, JS Murray, MC Concha Journal of Molecular Modeling 13, 643-650, 2007 | 380 | 2007 |
| Br··· O complexes as probes of factors affecting halogen bonding: interactions of bromobenzenes and bromopyrimidines with acetone KE Riley, JS Murray, P Politzer, MC Concha, P Hobza Journal of Chemical Theory and Computation 5 (1), 155-163, 2009 | 336 | 2009 |
| Links between surface electrostatic potentials of energetic molecules, impact sensitivities and C–NO2/N–NO2 bond dissociation energies JS Murray, MC Concha, P Politzer Molecular Physics 107 (1), 89-97, 2009 | 313 | 2009 |
| A possible crystal volume factor in the impact sensitivities of some energetic compounds M Pospíšil, P Vávra, MC Concha, JS Murray, P Politzer Journal of molecular modeling 16, 895-901, 2010 | 291 | 2010 |
| Catalytic hydrodeoxygenation of methyl-substituted phenols: Correlations of kinetic parameters with molecular properties FE Massoth, P Politzer, MC Concha, JS Murray, J Jakowski, J Simons The Journal of Physical Chemistry B 110 (29), 14283-14291, 2006 | 253 | 2006 |
| Blue shifts vs red shifts in σ-hole bonding JS Murray, MC Concha, P Lane, P Hobza, P Politzer Journal of molecular modeling 14, 699-704, 2008 | 249 | 2008 |
| Halogen bond tunability II: the varying roles of electrostatic and dispersion contributions to attraction in halogen bonds KE Riley, JS Murray, J Fanfrlík, J Řezáč, RJ Solá, MC Concha, FM Ramos, ... Journal of molecular modeling 19, 4651-4659, 2013 | 205 | 2013 |
| The complementary roles of molecular surface electrostatic potentials and average local ionization energies with respect to electrophilic processes P Politzer, JS Murray, MC Concha International journal of quantum chemistry 88 (1), 19-27, 2002 | 196 | 2002 |
| Computational prediction of standard gas, liquid, and solid‐phase heats of formation and heats of vaporization and sublimation P Politzer, Y Ma, P Lane, MC Concha International journal of quantum chemistry 105 (4), 341-347, 2005 | 150 | 2005 |
| Computational investigation of the structures and relative stabilities of amino/nitro derivatives of ethylene P Politzer, MC Concha, ME Grice, JS Murray, P Lane Journal of Molecular Structure: THEOCHEM 452 (1-3), 75-83, 1998 | 147 | 1998 |
| Reactivities of sites on (5, 5) single-walled carbon nanotubes with and without a Stone-Wales defect TC Dinadayalane, JS Murray, MC Concha, P Politzer, J Leszczynski Journal of Chemical Theory and Computation 6 (4), 1351-1357, 2010 | 145 | 2010 |
| Sensitivity and the available free space per molecule in the unit cell M Pospíšil, P Vávra, MC Concha, JS Murray, P Politzer Journal of molecular modeling 17, 2569-2574, 2011 | 143 | 2011 |
| The reaction force: Three key points along an intrinsic reaction coordinate P Politzer, A Toro-Labbé, S Gutiérrez-Oliva, B Herrera, P Jaque, ... Journal of Chemical Sciences 117, 467-472, 2005 | 141 | 2005 |
| Computational characterization of energetic materials P Politzer, JS Murray, JM Seminario, P Lane, ME Grice, MC Concha Journal of Molecular Structure: THEOCHEM 573 (1-3), 1-10, 2001 | 111 | 2001 |
| Analysis of two intramolecular proton transfer processes in terms of the reaction force A Toro-Labbé, S Gutiérrez-Oliva, MC Concha, JS Murray, P Politzer The Journal of chemical physics 121 (10), 4570-4576, 2004 | 96 | 2004 |
| An electrostatic correction for improved crystal density predictions of energetic ionic compounds P Politzer, J Martinez, JS Murray, MC Concha Molecular Physics 108 (10), 1391-1396, 2010 | 86 | 2010 |
