Cargando…
Halogen Bonds in Ligand–Protein Systems: Molecular Orbital Theory for Drug Design
[Image: see text] Halogen bonds are highly important in medicinal chemistry as halogenation of drugs, generally, improves both selectivity and efficacy toward protein active sites. However, accurate modeling of halogen bond interactions remains a challenge, since a thorough theoretical investigation...
| Autores principales: | , , , , , , |
|---|---|
| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
American Chemical
Society
2020
|
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7093837/ https://www.ncbi.nlm.nih.gov/pubmed/32003997 http://dx.doi.org/10.1021/acs.jcim.9b00946 |