Re: [AMBER-Developers] A QM GUI interface in the cloud

From: Daniel Roe <daniel.r.roe.gmail.com>
Date: Thu, 1 Apr 2021 09:00:20 -0400

That looks really cool Jason!

Any chance government (.gov) users will be able to take a look at
this, or is it going to be academic (.edu) only?

-Dan

On Wed, Mar 31, 2021 at 3:38 PM Jason Swails <jason.swails.gmail.com> wrote:
>
> Hi everyone,
>
> Entos has just released a molecular visualization and exploration tool for
> free academic use with one-touch QM properties (xTB level of theory for
> now). You can get conformer generation, optimization, torsion scans, IR
> spectra and vibrational intensities, orbitals, ESPs, bond dissociation
> energies, and more. I think it could be a very effective tool for
> instruction.
>
> We'd love to get feedback at envision.entos.ai for anyone that wants to
> explore with it. You can see a more detailed description here:
> https://www.entos.ai/blog/entos-envision-is-released-worldwide
>
> I hope everyone is well!
> Jason
>
> --
> Jason M. Swails
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> AMBER-Developers.ambermd.org
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Received on Thu Apr 01 2021 - 06:30:02 PDT
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