نتایج جستجو برای: noncovalent interactions

تعداد نتایج: 389161  

Journal: :Wiley Interdisciplinary Reviews: Computational Molecular Science 2014

2017
Peter Politzer Jane S. Murray Sławomir J. Grabowski

After a brief discussion of the σ-hole concept and the significance of molecular electrostatic potentials in noncovalent interactions, we draw attention to some common misconceptions that are encountered in that context: (1) Since the electrostatic potential reflects the contributions of both the nuclei and the electrons, it cannot be assumed that negative potentials correspond to “electron-ric...

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