Bond detectors for molecular dynamics simulations, Part I : Hydrogen bonds
Copyright © 2013 Wiley Periodicals, Inc.
| Publié dans: | Journal of computational chemistry. - 1984. - 34(2013), 26 vom: 05. Okt., Seite 2261-9 |
|---|---|
| Auteur principal: | |
| Autres auteurs: | |
| Format: | Article en ligne |
| Langue: | English |
| Publié: |
2013
|
| Accès à la collection: | Journal of computational chemistry |
| Sujets: | Journal Article Fukui function bond detectors charge sensitivity analysis hydrogen bond molecular dynamics simulations polarizable force-fields polarization matrix reactivity criteria softness/hardness |
| Accès en ligne |
Volltext |