AMBER: amber 8 problem

From: Vojtěch Klusák <klusak.uochb.cas.cz>
Date: Mon, 31 Jan 2005 14:01:35 +0100

Dears.

I have the following problem with AMBER 8.

Running command:

sander -O -i sander.in1 -o sander.out1 -r mdrest1 -e mden1 -c prmcrd1 -p

prmtop1

with the input files attached, I get a 'not-a-number' value in mden1
file (also attached).
It is a trifle bug, but causes problems to some program automatically
processing
sander output files.

Thank you very much.

Vojta


-----------------------------------------------------------------------
The AMBER Mail Reflector
To post, send mail to amber.scripps.edu
To unsubscribe, send "unsubscribe amber" to majordomo.scripps.edu

Received on Mon Jan 31 2005 - 13:53:01 PST
Custom Search