Loading...

Capturing Choline–Aromatics Cation−π Interactions in the MARTINI Force Field

[Image: see text] Cation−π interactions play an important role in biomolecular recognition, including interactions between membrane phosphatidylcholine lipids and aromatic amino acids of peripheral proteins. While molecular mechanics coarse grain (CG) force fields are particularly well suited to sim...

Fuld beskrivelse

Na minha lista:
Bibliografiske detaljer
Udgivet i:J Chem Theory Comput
Main Authors: Khan, Hanif M., Souza, Paulo C. T., Thallmair, Sebastian, Barnoud, Jonathan, de Vries, Alex H., Marrink, Siewert J., Reuter, Nathalie
Format: Artigo
Sprog:Inglês
Udgivet: American Chemical Society 2020
Online adgang:https://ncbi.nlm.nih.gov/pmc/articles/PMC7175457/
https://ncbi.nlm.nih.gov/pubmed/32096995
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/acs.jctc.9b01194
Tags: Tilføj Tag
Ingen Tags, Vær først til at tagge denne postø!