The electrostatical molecular potential ? A tool for the prediction of electrostatic molecular interaction properties
- 1 January 1980
- journal article
- Published by Springer Nature in Theoretical Chemistry Accounts
- Vol. 57 (3) , 245-253
- https://doi.org/10.1007/bf00554105
Abstract
No abstract availableKeywords
This publication has 18 references indexed in Scilit:
- A method of describing the charge distribution in simple moleculesJournal of the American Chemical Society, 1978
- Ab initioLCAO-MO-SCF calculation of the electrostatic molecular potential of chlorpromazine and promazineInternational Journal of Quantum Chemistry, 1978
- Study of anion binding to protonated nucleic acid bases using electrostatic molecular potentialsTheoretical Chemistry Accounts, 1978
- Anion binding to nucleic acid bases. A quantum-mechanical exploration using electrostatic molecular potentialsBiochemical and Biophysical Research Communications, 1977
- Simple model of hydrogen bondingJournal of the American Chemical Society, 1975
- The molecular electrostatic potential of the dimethyl phosphate anion: An ab initio studyChemical Physics Letters, 1975
- On the molecular electrostatic potentials obtained from CNDO wave functionsTheoretical Chemistry Accounts, 1975
- All valence electron wavefunctions and electrostatic molecular potentials under zero differential overlap approximationChemical Physics Letters, 1974
- On the molecular electrostatic potentials obtained with CNDO and INDO wave functionsTheoretical Chemistry Accounts, 1974
- Molecular electrostatic potentials: Comparison of ab initio and CNDO resultsTheoretical Chemistry Accounts, 1972