With Google
http://vienna-ptm.univie.ac.at/?page_id=100
HTH
------------------------------
Message: 4
Date: Tue, 7 May 2019 09:14:42 +0200
From: Mark Abraham <mark.j.abra...@gmail.com>
To: Discussion list for GROMACS users <gmx-us...@gromacs.org>
Cc: Discussion list for GROMACS users
<gromacs.org_gmx-users@maillist.sys.kth.se>
Subject: Re: [gmx-users] GROMOS 54A8 Force field
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<CAMNuMASUNWd=VQ3qJQNK5KD03O-Uib=vd6w5wecjfejgvxm...@mail.gmail.com>
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Hi,
I would contact the authors and ask them.
Mark
On Mon, 6 May 2019 at 11:30, Kalyanashis Jana <kalyan.chem...@gmail.com>
wrote:
> Dear users,
> Could you please suggest me where I can get the complete package of GROMOS
> 54A8 force filed developed by Prof. Dr. Chris Oostenbrink and co-worker (
> https://pubs.acs.org/doi/10.1021/ct300156h).
>
> Looking forward to your suggestions.
>
> Thanks in advance.
>
> Sincerely yours,
> Kalyanashis Jana
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------------------------------
Message: 5
Date: Tue, 7 May 2019 09:16:06 +0200
From: Mark Abraham <mark.j.abra...@gmail.com>
To: Discussion list for GROMACS users <gmx-us...@gromacs.org>
Subject: Re: [gmx-users] Error when compiling 2019.2 with -DGMX_MPI=ON
Message-ID:
<CAMNuMAQ8-g=ZiSvM4871AEv4a=9hdfg0ga8mzda+yr-5t1m...@mail.gmail.com>
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Hi Dallas,
The install guide tries to provide the hint to use the MPI wrapper
compilers (mpicc and mpicxx) that are installed alongside the MPI package
you installed (but maybe as part of the *mpi-dev package) . Perhaps we can
make that more clear. (And if you do, there's no need to set GMX_MPI, as
the build system will see what your intent is.) The symptoms you report
look very much like those that mpicc will handle internally.
Mark
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