Re: [AMBER] QMMM with MOPAC2016

From: Carlos SOTO GARZA <carlos.soto.garza.gmail.com>
Date: Tue, 10 Jan 2017 23:52:23 +0000

Dear Adrian and Andreas,
Many thanks.
My interest derived from the GPU aceleration present in MOPAC2016, which
would benefit calculations in larger systems.
Greetings,
Carlos

On Tue, Jan 10, 2017 at 11:37 PM, Goetz, Andreas <agoetz.sdsc.edu> wrote:

> Dear Carlos,
>
> There are currently no plans to support MOPAC2016. Most Hamiltonians are
> available directly in Amber.
>
> All the best,
> Andy
>
> —
> Dr. Andreas W. Goetz
> Assistant Project Scientist
> San Diego Supercomputer Center
> Tel: +1-858-822-4771
> Email: agoetz.sdsc.edu
> Web: www.awgoetz.de
>
> > On Jan 10, 2017, at 3:06 PM, Carlos SOTO GARZA <
> carlos.soto.garza.gmail.com> wrote:
> >
> > Helo there,
> > If I understand correct the AMBER2016 Manual, there are several interface
> > for several QM programs, but MOPAC2016 does not appear in the list. Will
> it
> > be suported?
> > Greetings,
> > Carlos
> >
> > --
> > Carlos GARZA
> > _______________________________________________
> > AMBER mailing list
> > AMBER.ambermd.org
> > http://lists.ambermd.org/mailman/listinfo/amber
>
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Received on Tue Jan 10 2017 - 16:00:04 PST
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