MAZE_LOSS ...
  LABEL=l

  PARAMS=1,1,1
... MAZE_LOSS

MAZE_RANDOM_ACCELERATION_MD ...
  LABEL=opt

  LOSS=l
  
  R_MIN=5
  OPTIMIZER_STRIDE=10

  LIGAND=2635-2646
  PROTEIN=1-2634

  NLIST
  NL_CUTOFF=7
  NL_STRIDE=100
... MAZE_RANDOM_ACCELERATION_MD

PRINT ...
  ARG=opt.sr
  FILE=colvar 
  FMT=%15.8f 
... PRINT
