Re: [AMBER] Amber Protonate for H++

From: Setyanto Md <stwahyudi.md.gmail.com> Date: Thu, 7 Dec 2017 10:17:44 +0700

---
Biophysics Division,
Department of Physics - Bogor Agricultural University
Gedung Fisika Wing-S Lt.2 Jl. Meranti (Depan Gymnasium)
Kampus IPB Darmaga
Bogor - 16680
Indonesia
On Thu, Dec 7, 2017 at 12:58 AM, Andreas Tosstorff <
andreas.tosstorff.cup.uni-muenchen.de> wrote:
> Hi all,
>
> I am trying to install H++ locally. The program requires the Amber
> program called "Protonate" which apparently is not included in
> AmberTools 16. Can you suggest how to work around this problem? Can I
> get ahold of the protonate files and use them with the AmberTools 16
> install? Should I install AmberTools 15 on top of 16? Or does it only
> come with the full Amber MD program?
>
> Any advice would be appreciated!
>
> Best,
> Andy
>
>
> --
> M.Sc. Andreas Tosstorff
> Lehrstuhl für Pharmazeutische Technologie und Biopharmazie
> Department Pharmazie
> LMU München
> Butenandtstr. 5-13 ( Haus B)
> 81377 München
> Germany
> Tel.: +49 89 2180 77059
>
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