---------- Forwarded message ----------
Date: Thu, 20 Dec 2001 11:45:21 -0800 (PST)
From: Bill Ross <ross_at_cgl.ucsf.edu>
To: mmadrid_at_psc.edu
Cc: amber_at_heimdal.compchem.ucsf.edu
Subject: Re: how to create a bond
hi, I am using xleap and want to create a bond between two atoms,
I "draw" it, but it does not get saved.
How do you know it does not get saved?
What is the simplest way to do this?
I tried in xleap
bond C1 N1
but I get the error message
bond: Argument #1 is of type String and it must be of type: [atom]
See the documentation - 'bond' requires unit.residue#.atomname.
I also tried writing it explicitly in the pdb file:
CONN 580 751
The pdb convention is CONECT.
Bill Ross
Received on Thu Dec 20 2001 - 12:37:11 PST
