AMBER Archive (2009)

Subject: Re: [AMBER] ERROR In Restraint file.

From: David A. Case (case_at_biomaps.rutgers.edu)
Date: Tue Apr 28 2009 - 11:17:36 CDT

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

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