Computational prediction of condensed phase properties from statistical characterization of molecular surface electrostatic potentials

2001 ◽  
Vol 185 (1-2) ◽  
pp. 129-137 ◽  
Author(s):  
Peter Politzer ◽  
Jane S. Murray
Keyword(s):  
Condensed Phase ◽  
Computational Prediction ◽  
Electrostatic Potentials ◽  
Molecular Surface ◽  
Statistical Characterization ◽  
Surface Electrostatic Potentials ◽  
Phase Properties

Molecular surface electrostatic potentials of anticonvulsant drugs

1998 ◽  
Vol 70 (6) ◽  
pp. 1137-1143 ◽  
Author(s):  
Jane S. Murray ◽  
Fakher Abu-Awwad ◽  
Peter Politzer ◽  
Leslie C. Wilson ◽  
Allan S. Troupin ◽  
...  
Keyword(s):  
Electrostatic Potentials ◽  
Anticonvulsant Drugs ◽  
Molecular Surface ◽  
Surface Electrostatic Potentials

Characterization of Surface Electrostatic Potentials of some (5,5) and (n,1) Carbon and Boron/Nitrogen Model Nanotubes

Nano Letters ◽  
2003 ◽  
Vol 3 (1) ◽  
pp. 21-28 ◽  
Author(s):  
Zenaida Peralta-Inga ◽  
Pat Lane ◽  
Jane S. Murray ◽  
Sylke Boyd ◽  
M. Edward Grice ◽  
...  
Keyword(s):  
Electrostatic Potentials ◽  
Nitrogen Model ◽  
Surface Electrostatic Potentials ◽  
Boron Nitrogen
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