TODO | ||
---|---|---|
Person | Task | State |
Martin | calculation of electrostatic potential map of (closed_atp_dimer, closed_atp),( closed_adp_dimer, closed_adp) | undone |
Martin | testing conditional state probabilities of simulation trajectories for convergence using HMM state definition (s-closed, closed, open) | undone |
Splette | MD runs of actin trimers to obtain relaxed filament part | undone |
Splette | calculation of 'mean' trimer structures which will serve as a basis for binding energy calculations | undone |
Martin | binding energy calculations of closed_atp/closed_adp/superclosed_atp trimer | undone |