Re: [AMBER] error in leap prmtop incprd preparation

From: Bill Ross <>
Date: Sun, 15 Jul 2018 13:37:16 -0700

> Created a new atom named: HE2 within residue: .R<GLU 277>
> Created a new atom named: HD2 within residue: .R<ASP 391>

Those two atom names need to match the ones in the template.

E.g. 'list GLU.1' might show the 'correct' atom names in GLU.


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Received on Sun Jul 15 2018 - 14:00:03 PDT
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