From: opronkri_at_msu.edu
Date: Fri Jun 17 2011 - 00:06:53 CDT
Hi everyone,
I am encountering this error upon running my config script for gradual heating:
ERROR: Multiple definitions of 'langevinTemp'
ERROR: in the configuration file are not allowed
I am aware that this can mean Tcl is not properly set up however I tried the precompiled binary and compiled NAMD with Tcl myself with no luck. Here is the portion of my script which is causing the error:
for {set TEMP 0} {$TEMP <=310} {incr TEMP 5} {
langevinTemp $TEMP
output heat.$TEMP
run 2000 ; #4ps
Is there something I can do to check if Tcl is working correctly? Or is there a better way to do the heating that avoids this scripting error?
Thanks in advance for your help.
Kris
This archive was generated by hypermail 2.1.6 : Wed Feb 29 2012 - 15:57:19 CST