Re: [AMBER] Problem when using lipid14 force filed in Amber 11

From: David A Case <>
Date: Mon, 11 Jan 2016 11:46:32 -0500

On Mon, Jan 11, 2016, Bin Wang wrote:

> (Residue 38: HSP, Nonterminal, was not found in name map.)
> Unknown residue: HSP number: 38 type: Nonterminal

This is a CHARMM-ism for protonated histidine (I think). Amber uses HIP
for this. It could be (?) that the Charmm_GUI is not correctly making
the substitution, so you may have to do that by hand.


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Received on Mon Jan 11 2016 - 09:00:05 PST
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