Weighted ensemble simulation for the LHCGR (active state) in POPC, with the RMSD as reaction coordinate in Å (dimension 0).

The inactive state was the reference for the RMSD calculation (TM domain). Variability of the RMSD over 100 iterations of 200 ps trajectories populated bins in the interval 3.6 to 4.9 Å. Up to 14 simultaneous trajectories per bin were generated in the simulation to sample states with low probability.

(TIF)