Anisotropic coarse-grain Monte Carlo simulations of lysozyme, lactoferrin, and NISTmAb by precomputing atomistic models.

Autor: Hatch, Harold W.1 (AUTHOR) harold.hatch@nist.gov, Bergonzo, Christina2,3 (AUTHOR), Blanco, Marco A.4 (AUTHOR), Yuan, Guangcui5 (AUTHOR), Grudinin, Sergei6 (AUTHOR), Lund, Mikael7 (AUTHOR), Curtis, Joseph E.8 (AUTHOR), Grishaev, Alexander V.2,3 (AUTHOR), Liu, Yun5,9 (AUTHOR), Shen, Vincent K.1 (AUTHOR)
Zdroj: Journal of Chemical Physics. 9/7/2024, Vol. 161 Issue 9, p1-14. 14p.
Databáze: Academic Search Ultimate