if tests are ok then no need to recompile with g95.
--- On Sun, 8/11/09, Sudeep Narayan Banerjee <sudeep.bose.res.in> wrote:
> From: Sudeep Narayan Banerjee <sudeep.bose.res.in>
> Subject: Re: [AMBER]Amber10 + g95
> To: "AMBER Mailing List" <amber.ambermd.org>
> Date: Sunday, 8 November, 2009, 2:56 AM
> Dear All,
>
> I have installed amber10 in
> CentOS, compiled with gfortran. I ran the
> test file and the results were OK. Is it necessary to
> compile with g95
> compiler once again?
>
> --
> Best Regards,
> Sudeep Narayan Banerjee
> Junior Computer Engineer
> S N Bose National Centre for Basic Sciences
> Block JD, Sector III, Saltlake City,
> Kolkata 700098
> Email: sudeep.bose.res.in
>
> ---------- Original Message -----------
> From: Peter Schmidtke <pschmidtke.mmb.pcb.ub.es>
> To: AMBER Mailing List <amber.ambermd.org>
> Sent: Sat, 07 Nov 2009 16:58:18 +0100
> Subject: Re: [AMBER] linux version for Amber10
>
> > I have seen running Amber10 in different
> distributions, so for
> > example openSuse 11.1 64 bit, Ubuntu, FC, Centos.
> >
> > What is the nature of your problem? Did you try to
> compile sander
> > etc with the ifort compiler from Intel? We noticed a
> huge increase
> > in calculation performance compared to gfortran the
> compiler.
> >
> > Best regards.
> >
> > Peter
> >
> > On Sat, 07 Nov 2009 07:28:05 -0800, liangchen88.ucla.edu
> wrote:
> > > What is the best version of linux for Amber10?
> > > my running process of Amber10 always has some
> problem,I guess it may
> > > have relationship with the linux system we are
> using.
> > >
> > > _______________________________________________
> > > AMBER mailing list
> > > AMBER.ambermd.org
> > > http://lists.ambermd.org/mailman/listinfo/amber
> >
> > --
> >
> > Peter Schmidtke
> >
> > ----------------------
> > PhD Student at the Molecular Modeling and
> Bioinformatics Group
> > Dep. Physical Chemistry
> > Faculty of Pharmacy
> > University of Barcelona
> >
> > _______________________________________________
> > AMBER mailing list
> > AMBER.ambermd.org
> > http://lists.ambermd.org/mailman/listinfo/amber
> ------- End of Original Message -------
>
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Received on Sat Nov 07 2009 - 20:00:03 PST
