Table of Simulations for 1THQ


Length Environment Final Snapshot RMSD/RMSF Bilayer Distortion Contacts Notes
200 ns DPPC self assembly
200 ns POPE, POPG 80:20 self assembly
200 ns DPC micelle assembly 90 molecules
200 ns DPC micelle assembly 100 molecules
200 ns DPC micelle assembly 110 molecules
200 ns POPC self assembly
200 ns PLPC self assembly
200 ns DLPC self assembly
200 ns DPPC self assembly 300 K
200 ns DPPC self assembly
200 ns POPC self-assembly at 300 K

Structural Bioinformatics & Computational Biochemistry, University of Oxford.