Re: [AMBER] problems in reading molecule in tleap/xleap

From: FyD <fyd.q4md-forcefieldtools.org>
Date: Tue, 08 Nov 2011 12:39:52 +0100

Urszula,

> I have an peptide with a mutated-residue, in this case it is (PHE5
> with an extra O), I created library for this residue but I am still
> getting the errosr:

the atom & residue names in your PDB file have to match these in your
FF libraries...

regards, Francois



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Received on Tue Nov 08 2011 - 04:00:02 PST
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