SCALE

NAME
SCALE - Periodic temperature scaling

SYNOPSIS
SCALE fscale

DESCRIPTION
Use this command for periodically re-scale the temperature with frequency fscale in units of femtoseconds. Scaling stands here for random initialization of the system velocities at temperature temp according to a Gaussian distribution.

EXAMPLES
SCALE 100.0
Reinitialize the system velocities every 100 fs.

WARNINGS
Work only during the rejection phase (see REJECT in environment &RUN).