2 papers
math.AP2007
Long-time convergence of an Adaptive Biasing Force method
Tony Lelievre, Felix Otto, Mathias Rousset +1
We propose a proof of convergence of an adaptive method used in molecular dynamics to compute free energy profiles. Mathematically, it amounts to studying the long-time behavior of…
cond-mat.stat-mech2005
Equilibrium Sampling From Nonequilibrium Dynamics
Mathias Rousset, Gabriel Stoltz
We present some applications of an Interacting Particle System (IPS) methodology to the field of Molecular Dynamics. This IPS method allows several simulations of a switched random…