Hi,
This works fine.
All Gromacs file format/programs are single/double compatible both ways.
Reading a double precision file with a single precision program,
or course, gives single precision results.
But there is probably no property that is significantly affected by this.
Berk
> Date: Wed, 26 Nov 2008 20:14:28 +1100
> From: [EMAIL PROTECTED]
> To: gmx-users@gromacs.org
> Subject: Re: [gmx-users] Using double precision files with single precision
> version
>
> vivek sharma wrote:
> > Hi All,
> > I had a few MD runs with double precision in gromacs, Can I use single
> > precision version of gromacs to play with those files e.g making movie
> > files and extracting h_bond information.
> > I am afraid if it will affect my results.
>
> I don't know whether it does work, but I suspect not. However it's
> trivial to compile a double-precision version, with --enable-double and
> --program-suffix=_d, and once installed you can use g_hbond when you
> want and g_hbond_d when you want.
>
> Mark
> _______________________________________________
> gmx-users mailing list gmx-users@gromacs.org
> http://www.gromacs.org/mailman/listinfo/gmx-users
> Please search the archive at http://www.gromacs.org/search before posting!
> Please don't post (un)subscribe requests to the list. Use the
> www interface or send it to [EMAIL PROTECTED]
> Can't post? Read http://www.gromacs.org/mailing_lists/users.php
_________________________________________________________________
Express yourself instantly with MSN Messenger! Download today it's FREE!
http://messenger.msn.click-url.com/go/onm00200471ave/direct/01/
_______________________________________________
gmx-users mailing list gmx-users@gromacs.org
http://www.gromacs.org/mailman/listinfo/gmx-users
Please search the archive at http://www.gromacs.org/search before posting!
Please don't post (un)subscribe requests to the list. Use the
www interface or send it to [EMAIL PROTECTED]
Can't post? Read http://www.gromacs.org/mailing_lists/users.php
