Unraveling Binding Mechanism and Stability of Urease Inhibitors: A QM/MM MD Study
Soil bacteria can produce urease, which catalyzes the hydrolysis of urea to ammonia (NH<sub>3</sub>) and carbamate. A variety of urease inhibitors have been proposed to reduce NH<sub>3</sub> volatilization by interfering with the urease activity. We report a quantum mechanics...
| Glavni autori: | , , |
|---|---|
| Format: | Članak |
| Jezik: | English |
| Izdano: |
MDPI AG
2023-03-01
|
| Serija: | Molecules |
| Teme: | |
| Online pristup: | https://www.mdpi.com/1420-3049/28/6/2697 |