Official websites use .gov
A
.gov website belongs to an official
government organization in the United States.
Secure .gov websites use HTTPS
A lock (
) or https:// means you've safely
connected to the .gov website. Share sensitive
information only on official, secure websites.
Molecular docking affinity energy and interaction groups calculated using AutoDock vinna for the POH/βCD complex.
| Compound | Affinity (kcal/mol) | Interaction | Interaction Type | From | To | Distance (Å) |
|---|---|---|---|---|---|---|
| Perillyl Alcohol | −4.0 | O | Hydrogen Bond | Perillyl Alcohol (OH in C10) | βCD (OH in C6) | 2.23 |
