[gmx-developers] Dependence on libxml2
Berk Hess
hessb at mpip-mainz.mpg.de
Wed Sep 17 09:08:09 CEST 2008
Hi,
But in Gromacs 4 xml is no longer used, is it?
But I think xml still has to be removed from the configure script.
Berk
David van der Spoel wrote:
> Roland Schulz wrote:
>> Hi,
>>
>> also on cross compile clusters (Cray, Bluegene), libxml(2) is not
>> installed on the Compute-Node but only on the frontend. Since having
>> to cross compile another library is a pain, it would be great if
>> mdrun could be compiled without libxml(2).
>
> Interesting challenge indeed. I guess what we have to do is to
> minimize the interdependencies between the code. That is, mdrun should
> not depend on the entire gmxlib.
>
>
>>
>> Roland
>>
>> On Mon, Sep 8, 2008 at 4:18 AM, Marc F. Lensink
>> <lensink at bigre.ulb.ac.be <mailto:lensink at bigre.ulb.ac.be>> wrote:
>>
>> On Sat, Sep 06, 2008 at 02:07:42PM +0200, David van der Spoel wrote:
>> > Hi,
>> >
>> > the inclusion of the xml library is currently limited to stuff
>> in the
>> > contrib directory. However we have discussed on many occasions
>> which xml
>> > library to use if we were going to make the move. The de-facto
>> standard
>> > in the linux world is libxml2 (foundation of the gnome project).
>> Are you
>> > aware of any platform where this wouldn't work?
>> >
>> > Do you see any other obvious drawbacks?
>>
>> libxml2 is the way to go. however, some clusters may have been
>> installed with older linux distributions, eg of the SL 3 series.
>> ancient, but stable. in those cases libxml2 can still be installed,
>> but only manually and its functionality is limited. one of the
>> issues
>> I recall is problems with namespace support.
>>
>> cheers,
>> marc
>>
>>
>> --
>> Marc F. Lensink
>> Centre for Structural Biology and Bioinformatics CSBB
>> Université Libre de Bruxelles marc.lensink at ulb.ac.be
>> <mailto:marc.lensink at ulb.ac.be>
>> Boulevard du Triomphe - CP 263, B-1050 Brussels, Belgium
>> tel: +32 2 650 5411 secr: +32 2 650 2013 fax: +32 2 650 5425
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>>
>>
>>
>> --
>> ORNL/UT Center for Molecular Biophysics cmb.ornl.gov
>> <http://cmb.ornl.gov>
>>
>>
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