# input and output filenames outputName output/smd set inputname ../../system/eq binCoordinates $inputname.coor binVelocities $inputname.vel extendedSystem $inputname.xsc set firsttime 0; # restart time source ../../system/glpt.inp; # other namd input parameters # colvar script colvars on colvarsConfig colvars.conf # simulation time = 4ns run 2000000