Re: [AMBER] GAFF parameters in amber16 and amber14

From: Hannes Loeffler <Hannes.Loeffler.stfc.ac.uk>
Date: Fri, 19 May 2017 08:21:17 +0100

On Fri, 19 May 2017 15:14:19 +0800
Meiting Wang <wangmeitingbetter.163.com> wrote:

> Dear all ,
> The parameters of GAFF in amber16 are different from that in
> amber14. GAFF2 has been available in amber16.
> Why GAFF is different in the two versions of amber?

Do you mean gaff.dat? The first line tells you what version you are
using and at the end of the file you will find a version history with
details what has changed.

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Received on Fri May 19 2017 - 00:30:03 PDT
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