Wird geladen...
Polarizable Empirical Force Field for Sulfur-Containing Compounds Based on the Classical Drude Oscillator Model
Condensed-phase computational studies of molecules using molecular mechanics approaches require the use of force fields to describe the energetics of the systems as a function of structure. The advantage of polarizable force fields over non-polarizable (or additive) models lies in their ability to v...
Gespeichert in:
| Hauptverfasser: | , |
|---|---|
| Format: | Artigo |
| Sprache: | Inglês |
| Veröffentlicht: |
2010
|
| Schlagworte: | |
| Online Zugang: | https://ncbi.nlm.nih.gov/pmc/articles/PMC2923574/ https://ncbi.nlm.nih.gov/pubmed/20575015 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1002/jcc.21527 |
| Tags: |
Tag hinzufügen
Keine Tags, Fügen Sie den ersten Tag hinzu!
|