Wird geladen...
Generalized image charge solvation model for electrostatic interactions in molecular dynamics simulations of aqueous solutions
This paper extends the image charge solvation model (ICSM) [J. Chem. Phys. 131, 154103 (2009)], a hybrid explicit/implicit method to treat electrostatic interactions in computer simulations of biomolecules formulated for spherical cavities, to prolate spheroidal and triaxial ellipsoidal cavities, de...
Gespeichert in:
| Hauptverfasser: | , , , , |
|---|---|
| Format: | Artigo |
| Sprache: | Inglês |
| Veröffentlicht: |
2013
|
| Schlagworte: | |
| Online Zugang: | https://ncbi.nlm.nih.gov/pmc/articles/PMC3728380/ https://ncbi.nlm.nih.gov/pubmed/23913979 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1016/j.jcp.2013.03.027 |
| Tags: |
Tag hinzufügen
Keine Tags, Fügen Sie den ersten Tag hinzu!
|