[gmx-users] The official release of GROMACS 2018 ; Re: gromacs.org_gmx-users Digest, Vol 165, Issue 39

Adarsh V. K. adarsh_p130085bt at nitc.ac.in
Fri Jan 12 07:05:18 CET 2018


In case of Protein-ligand simulation,

1) Whether all commands used in GROMACS 5.1.4 is supported in GROMACS 2018
also ?.

2) Can I use a data file generated by Gromacs 5.1.4 in Gromacs 2018 to
extend a completed protein-ligand simulation?. If yes which data file I
should exactly copy to extend the simulation in new folder.

------------------------------
>
> Message: 4
> Date: Thu, 11 Jan 2018 02:30:15 +0000
> From: Mark Abraham <mark.j.abraham at gmail.com>
> To: Discussion list for GROMACS users <gmx-users at gromacs.org>,
>         " gmx-announce at gromacs.org" <gmx-announce at gromacs.org>
> Subject: [gmx-users] GROMACS 2018 official release
> Message-ID:
>         <CAMNuMARcuLVp9E6rRnYCm01QK2oMyfSicRPCkrfd2bgRCYd_bA at mail.
> gmail.com>
> Content-Type: text/plain; charset="UTF-8"
>
> Hi GROMACS users,
>
> The official release of GROMACS 2018 is now available.
>
> What new things can you expect? Please see the release notes highlights at
> http://manual.gromacs.org/documentation/2018/release-notes/index.html.
>
> You can find the code, manual, release notes, installation instructions and
> test suite at the links below.
>
> Code: ftp://ftp.gromacs.org/pub/gromacs/gromacs-2018.tar.gz
> Documentation: http://manual.gromacs.org/documentation/2018/index.html
> (includes install guide, user guide, reference manual, and release notes)
> Test Suite: http://gerrit.gromacs.org/download/regressiontests-2018.tar.gz
>
> Happy simulating!
>
> Mark Abraham
> GROMACS development manager
>


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