[AMBER] Changed atom name in NME cap residue library

From: Jong Young Joung via AMBER <amber.ambermd.org>
Date: Thu, 16 May 2024 16:23:07 +0900

Dear Amber users,

Does anyone know the reason why the name of the carbon atom in NME capping
residue changes from 'CH3' (in Amber20) to 'C' (in Amber22)?

When I compared the 'aminoct12.lib' files in amber20 and amber22, I found
it.
However in Chap13, p229 in Amber23 manual, the atom names of NME are
described as N and CH3.

Thanks in advance

Young
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Received on Thu May 16 2024 - 00:30:02 PDT