Optimal Langevin modeling of out-of-equilibrium molecular dynamics simulations.

Micheletti, Cristian

Optimal Langevin modeling of out-of-equilibrium molecular dynamics simulations. [electronic resource] - The Journal of chemical physics Aug 2008 - 074105 p. digital

Publication Type: Journal Article

1089-7690

10.1063/1.2969761 doi


Algorithms
Computer Simulation
Diffusion
Kinetics
Models, Chemical
Polymers--chemistry
Time Factors