VMD-L Mailing List

From: Axel Kohlmeyer (akohlmey_at_cmm.chem.upenn.edu)
Date: Mon Mar 24 2008 - 19:53:36 CDT

On Mon, 24 Mar 2008, Irene Newhouse wrote:

IN> #initialize
IN> set numfr 350
IN> set pref h5a100
IN> set mymol [mol new parm7 $pref.prmtop]

ok. this is not the correct syntax. see the docs.
you have to use:

set mymol [mol new $pref.prmtop type parm7 waitfor all]

this has the advantage of having a consistent syntax with
mol addfile...

[...]

IN> Thanks!

cheers,
   axel. 

-- 
=======================================================================
Axel Kohlmeyer   akohlmey_at_cmm.chem.upenn.edu   http://www.cmm.upenn.edu
   Center for Molecular Modeling   --   University of Pennsylvania
Department of Chemistry, 231 S.34th Street, Philadelphia, PA 19104-6323
tel: 1-215-898-1582,  fax: 1-215-573-6233,  office-tel: 1-215-898-5425
=======================================================================
If you make something idiot-proof, the universe creates a better idiot.