Wird geladen...
Development and Validation of the Quantum Mechanical Bespoke Protein Force Field
[Image: see text] Molecular mechanics force field parameters for macromolecules, such as proteins, are traditionally fit to reproduce experimental properties of small molecules, and thus, they neglect system-specific polarization. In this paper, we introduce a complete protein force field that is de...
Gespeichert in:
| Veröffentlicht in: | ACS Omega |
|---|---|
| Hauptverfasser: | , , , |
| Format: | Artigo |
| Sprache: | Inglês |
| Veröffentlicht: |
American Chemical Society
2019
|
| Online Zugang: | https://ncbi.nlm.nih.gov/pmc/articles/PMC6740169/ https://ncbi.nlm.nih.gov/pubmed/31528808 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/acsomega.9b01769 |
| Tags: |
Tag hinzufügen
Keine Tags, Fügen Sie den ersten Tag hinzu!
|