Molecular electrostatic fields from bond fragments-Reference-Cited by-同舟云学术

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Molecular electrostatic fields from bond fragments

Published:1987-06 Issue:6 Volume:31 Page:927-939
ISSN:0020-7608
Container-title:International Journal of Quantum Chemistry
language:en
Short-container-title:Int. J. Quantum Chem.

Author:

Nagy Péter,Ángyán János G.,Náray-Szabó Gábor,Peinel Gustav

Publisher

Wiley

Subject

Physical and Theoretical Chemistry,Condensed Matter Physics,Atomic and Molecular Physics, and Optics

Reference31 articles.

1. The electrostatical molecular potential ? A tool for the prediction of electrostatic molecular interaction properties

2. Construction of hydration shells for the tautomeric forms of heterocycles based on electrostatic potentials

3. Molecular electrostatic potential field. significance for DNA and its constituents.

4. An approach to computing electrostatic charges for molecules

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1. Editorial: in memoriam János G. Ángyán (1956–2017);Theoretical Chemistry Accounts;2018-11-15

2. Large-Scale Computations in Chemistry: A Bird’s Eye View of a Vibrant Field;Chemical Reviews;2015-04-08

3. Molecular Electrostatic Potentials and Chemical Reactivity;Reviews in Computational Chemistry;2007-01-05

4. Electrostatic Potentials: Chemical Applications;Encyclopedia of Computational Chemistry;2002-04-15

5. Polarization properties of ZnO and BeO: Anab initiostudy through the Berry phase and Wannier functions approaches;Physical Review B;2001-12-12

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