Tuning Potential Functions to Host–Guest Binding Data.

Autor: Setiadi, Jeffry, Boothroyd, Simon, Slochower, David R., Dotson, David L., Thompson, Matthew W., Wagner, Jeffrey R., Wang, Lee-Ping, Gilson, Michael K.
Zdroj: Journal of Chemical Theory & Computation; 1/9/2024, Vol. 20 Issue 1, p239-252, 14p
Databáze: Supplemental Index