AMBER Archive (2004)Subject: Re: AMBER: sander8
From: Vincent Bisetty (bisettyk_at_dit.ac.za)
Date: Sat Oct 09 2004 - 11:13:55 CDT
Dear Carlos,
Thanks for your message. Using the input files from my last message, I
executed sander.run (in amber8)-the job ran, but my tmp.out was a blank
file. Iam not sure why? Please help...
Heres the other sander input file:
cd /usr/people/vincent/disk2/vin/cage03
/usr/local/amber8/exe/sander \
-O -i amber8min.in -c 1000.crd -p xo3.top -o tmp.out -r 1000.rst
regards
vincent.
--
Dr K Bisetty
Senior Lecturer
Department of Chemistry
Steve Biko Campus
Durban Institute of Technology
P O BOX 1334
Durban
4000
Tel : +27-031-2042311
Fax : +27-031-2022671
"ND-4-SPD"
bisettyk_at_dit.ac.za
------------------------------------------------------------------------------
Are you happy with the service you receive from my office?
If so - send a compliment; if not send a complaint to: quality_at_dit.ac.za
Please read our disclaimer http://www.dit.ac.za/disclaimer/emaildisclaimer.htm
------------------------------------------------------------------------------
<<<<GWAVAsig>>>>
-----------------------------------------------------------------------
The AMBER Mail Reflector
To post, send mail to amber_at_scripps.edu
To unsubscribe, send "unsubscribe amber" to majordomo_at_scripps.edu
|