addles

From: Eoin Galligan <paxeg_at_nottingham.ac.uk>
Date: Wed 04 Jul 2001 14:18:59 +0100

Hi
I am trying to set up parm and crd files for a LES, simulation. However, addles does not write the parm or crd files. The output from addles is below. Any ideas where I'm going wrong?

Regards, E.Galligan

output file:

add_les> ~
add_les> ~ LES input for DHFR-MTX Simulation
add_les> ~
add_les> ~ first specify input top file
add_les> ~
add_les> file rprm name=(dhfrmtx_3.top) read
  The following unit number was assigned 26
                                                                                 
 Checking topology sizes against compiled limits
 Checking topology sizes against compiled limits
add_les> ~
add_les> ~ then specify coordinates
add_les> ~
add_les> file rcvb name=(dhfrmtx_3.crd) read
  The following unit number was assigned 27
 Coords, velocities and box from unit 27
                                                                                
 Reading coordinates from input file
 Reading velocities from input file
 crd file end
Received on Wed Jul 04 2001 - 06:18:59 PDT