The quantum theory of atoms in molecules: from solid state to DNA and drug design A Becke John Wiley & Sons, 2007 | 1898 | 2007 |
On the importance of prereactive complexes in molecule− radical reactions: Hydrogen abstraction from aldehydes by OH JR Alvarez-Idaboy, N Mora-Diez, RJ Boyd, A Vivier-Bunge Journal of the American Chemical Society 123 (9), 2018-2024, 2001 | 287 | 2001 |
Extended weak bonding interactions in DNA: π-stacking (base− base), base− backbone, and backbone− backbone interactions CF Matta, N Castillo, RJ Boyd The Journal of Physical Chemistry B 110 (1), 563-578, 2006 | 282 | 2006 |
An introduction to the quantum theory of atoms in molecules CF Matta, RJ Boyd The quantum theory of atoms in molecules, 1-34, 2007 | 273 | 2007 |
Electron affinities and ionization potentials of nucleotide bases SD Wetmore, RJ Boyd, LA Eriksson Chemical Physics Letters 322 (1-2), 129-135, 2000 | 258 | 2000 |
Density functional study of the proline-catalyzed direct aldol reaction KN Rankin, JW Gauld, RJ Boyd The Journal of Physical Chemistry A 106 (20), 5155-5159, 2002 | 239 | 2002 |
Polarizable point‐charge model for water: Results under normal and extreme conditions IM Svishchev, PG Kusalik, J Wang, RJ Boyd The Journal of chemical physics 105 (11), 4742-4750, 1996 | 221 | 1996 |
Sulfur-sulfur bond lengths, or can a bond length be estimated from a single parameter? O Knop, RJ Boyd, SC Choi Journal of the American Chemical Society 110 (22), 7299-7301, 1988 | 215 | 1988 |
Characterization of a closed-shell fluorine− fluorine bonding interaction in aromatic compounds on the basis of the electron density CF Matta, N Castillo, RJ Boyd The Journal of Physical Chemistry A 109 (16), 3669-3681, 2005 | 186 | 2005 |
The shell structure of atoms and the Laplacian of the charge density Z Shi, RJ Boyd The Journal of chemical physics 88 (7), 4375-4377, 1988 | 178 | 1988 |
Hydrogen bonding between nitriles and hydrogen halides and the topological properties of molecular charge distributions RJ Boyd, SC Choi Chemical physics letters 129 (1), 62-65, 1986 | 168 | 1986 |
A density functional study of methanol clusters SL Boyd, RJ Boyd Journal of Chemical Theory and Computation 3 (1), 54-61, 2007 | 162 | 2007 |
Group electronegativities from the bond critical point model RJ Boyd, SL Boyd Journal of the American Chemical Society 114 (5), 1652-1655, 1992 | 157 | 1992 |
A bond-length-bond-order relationship for intermolecular interactions based on the topological properties of molecular charge distributions RJ Boyd, SC Choi Chemical physics letters 120 (1), 80-85, 1985 | 152 | 1985 |
Atomic and group electronegativities from the electron-density distributions of molecules RJ Boyd, KE Edgecombe Journal of the American Chemical Society 110 (13), 4182-4186, 1988 | 149 | 1988 |
An SCF–MO–CNDO study of equilibrium geometries, force constants, and bonding energies: CNDO/BW. Part I. Parameterization RJ Boyd, MA Whitehead Journal of the Chemical Society, Dalton Transactions, 73-77, 1972 | 147* | 1972 |
A theoretical study of 5-halouracils: electron affinities, ionization potentials and dissociation of the related anions SD Wetmore, RJ Boyd, LA Eriksson Chemical physics letters 343 (1-2), 151-158, 2001 | 132 | 2001 |
Selenium stories R Boyd Nature chemistry 3 (7), 570-570, 2011 | 128 | 2011 |
The 28-Electron Tetraatomic Molecules: N4, CN2O, BFN2, C2O2, B2F2, CBFO, C2FN, and BNO2. Challenges for Computational and Experimental … AA Korkin, A Balkova, RJ Bartlett, RJ Boyd, PR Schleyer The Journal of Physical Chemistry 100 (14), 5702-5714, 1996 | 125 | 1996 |
A quantum mechanical explanation for Hund's multiplicity rule RJ Boyd Nature 310 (5977), 480-481, 1984 | 124 | 1984 |