Program add_cooling_rate

This program adds the cooling rate to the specified init file. The cooling rate is calculated from temperatures in the specified traj file.

Configuration file

The options for the execution of add_cooling_rate can be set in the configuration file add_cooling_rate.inp:

data/traj_CIR_3d_06111112_06111212.nc  ! traj file
data/init_CIR_06111112.nc              ! pos file

ClamsTools/add_cooling_rate (last edited 2010-04-29 08:41:17 by NicoleThomas)