Re: [AMBER] ERROR In Restraint file.

From: David A. Case <case.biomaps.rutgers.edu>
Date: Tue, 28 Apr 2009 17:17:36 +0100

On Tue, Apr 28, 2009, Catein Catherine wrote:
>
> Error: No atom p in residue 4
> Error: No atom n2 in residue 5

Just a wild guess: atom names are case sensitive: is the atom in the
prmtop file named "p" or is it "P"? The atom names in the restraint
files have to exactly match those in the prmtop file.

...dac


_______________________________________________
AMBER mailing list
AMBER.ambermd.org
http://lists.ambermd.org/mailman/listinfo/amber
Received on Wed May 20 2009 - 13:13:56 PDT
Custom Search