[gmx-users] a new GROMACS simulation tool

[Thales Kronenberger]

I also would like to try




2013/10/23 Gloria Saracino <glosara at yahoo.it>

> Dear Kevin,
> I'm Gloria Saracino from the Center of Nanomedicine and Tissue Engineering
> of the Hospital of Niguarda Ca' Granda in Milan, Italy.
>
> I'm interested into knowing more about this new web based toolas I use MD
> everyday.
> Let me know what I have to do.
>
> Regards,
>
>
> Gloria Saracino
>
>
>
> ________________________________
>  Da: Kevin Chen <fch6699 at gmail.com>
> A: 'Discussion list for GROMACS users' <gmx-users at gromacs.org>
> Inviato: Martedì 22 Ottobre 2013 16:34
> Oggetto: [gmx-users] a new GROMACS simulation tool
>
>
> Hi Everyone,
>
> I'm writing to let you guys know that we have developed a web-based tool MD
> simulation tool for GROMACS.  It is a software package primarily developed
> for biological MD and offers a huge amount of possible options and settings
> for tailoring the simulations. Seamlessly integrated with newly developed
> GUI interfaces, the tool provides comprehensive setup, simulation, analysis
> and job submission tools. Most importantly, unlike other GROMACS GUI
> applications, user can actually run really simulations using the dedicated
> HPC resources. That been said, there's no proposal and installation
> required.  This tool could be a great fit for both teaching and research
> projects. Users inexperienced in MD can work along prepared workflows,
> while
> experts may enjoy a significant relief from the tedium of typing and
> scripting. As for now, we'd like to invite people to participate in user
> testing on this newly developed tool. Let me know if you'd like to try it
> out. We will set up an account for you.
>
> Best Regards,
>
> Kevin Chen, Ph.D.
> Information Technology at Purdue (ITaP)
> West Lafayette, IN 47907-2108
>
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