[AMBER] xleap as a molecular viewer

From: Guenegou, Guillaume [ORDFR] <GGUENEGO.ITS.JNJ.com>
Date: Tue, 17 May 2011 15:12:05 +0200

Dear all,

I would like to use xleap as a molecular viewer (I know it is not the
best idea on earth, but I have to!). I believe it is possible. I work
with Amber11.

My command is: $AMBHOME/exe/xleap -f leap.in

leap.in =

source leaprc.ff03.r1

source leaprc.gaff

complex = loadPdb file.pdb

 

Is there anything I am doing wrong?

Regards,

G.GUENEGOU

 

_______________________________________________
AMBER mailing list
AMBER.ambermd.org
http://lists.ambermd.org/mailman/listinfo/amber
Received on Tue May 17 2011 - 06:30:02 PDT
Custom Search