[PyMOL] Pymol on MacMini: performances

2005-06-14 Thread Luca Fenu

Hi everyone,

I'm thinking of buying a Mac mini to use as minimal computer for home, 
and will need it to run pymol smoothly. is this the case, or the little 
machine doesn't have enough juice to handle, let's say, visualisation of 
a protein active site and ligand docked into it, with different level of 
transparence and such? I need pymol essentially to look at my structure 
and generate pretty pictures for my phD thesis... many thanks to anyone 
can give insights...


   luca
--
S for stupendous! T for Tiger, ferocity of! U for Underwear, red! P for 
Power, incredible! E for Excellent physique! N for ...um... something... 
hmm, well I'll come back to that... D for Determination! U.. for... 
wait, how do you spell this? Is it 'I'?





Re: [PyMOL] Pymol on MacMini: performances

2005-06-14 Thread Sabuj Pattanayek
Hi,

I can run pymol smoothly on my celeron-m 1.3ghz laptop with intel
i855gmch embedded graphics chip. This has no dedicated memory and uses a
portion of the 512MB system ram for graphics processing.

The specs say that mac mini's come standard with ati r9200 with 32mb
*dedicated* ram for graphics so you should have no problems. In general
a dedicated ati or nvidia chip has more opengl capabilities than
embedded intel or sis graphics chips. A $50 upgrade to 512MB would help
tremendously however.

Hope that helps,
Sabuj Pattanayek

Luca Fenu wrote:
> Hi everyone,
> 
> I'm thinking of buying a Mac mini to use as minimal computer for home,
> and will need it to run pymol smoothly. is this the case, or the little
> machine doesn't have enough juice to handle, let's say, visualisation of
> a protein active site and ligand docked into it, with different level of
> transparence and such? I need pymol essentially to look at my structure
> and generate pretty pictures for my phD thesis... many thanks to anyone
> can give insights...
> 
>luca




Re: [PyMOL] Pymol on MacMini: performances

2005-06-14 Thread Luca Fenu

Thanks Sabuj,

I thought so, but couldn't be sure, as a lot depends on the quality of 
the drivers... w/o Direct Rendering (ATI drivers sucks!), my ath64 
laptop with R9700 only manages to give me some 4 fps... that makes it 
all but unusable. so i was afraid to find myself in an even worst 
situation... Hopefully, PyMol takes advantage of Altivec... I'll give it 
a try. thanks again...


   luca

Sabuj Pattanayek wrote:


 Hi,

 I can run pymol smoothly on my celeron-m 1.3ghz laptop with intel
 i855gmch embedded graphics chip. This has no dedicated memory and
 uses a portion of the 512MB system ram for graphics processing.

 The specs say that mac mini's come standard with ati r9200 with 32mb
 *dedicated* ram for graphics so you should have no problems. In
 general a dedicated ati or nvidia chip has more opengl capabilities
 than embedded intel or sis graphics chips. A $50 upgrade to 512MB
 would help tremendously however.

 Hope that helps, Sabuj Pattanayek

 Luca Fenu wrote:

> Hi everyone,
>
> I'm thinking of buying a Mac mini to use as minimal computer for
> home, and will need it to run pymol smoothly. is this the case, or
> the little machine doesn't have enough juice to handle, let's say,
> visualisation of a protein active site and ligand docked into it,
> with different level of transparence and such? I need pymol
> essentially to look at my structure and generate pretty pictures
> for my phD thesis... many thanks to anyone can give insights...
>
> luca




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--
S for stupendous! T for Tiger, ferocity of! U for Underwear, red! P for 
Power, incredible! E for Excellent physique! N for ...um... something... 
hmm, well I'll come back to that... D for Determination! U.. for... 
wait, how do you spell this? Is it 'I'?





Re: [PyMOL] Pymol on MacMini: performances

2005-06-15 Thread Dirk Kostrewa

Dear Luca,

I own a current G4 iBook, and the Mac mini is in principle an iBook in 
cubuoid form (but without display and keyboard). I don't know how 
demanding your pymol sessions are, but I'm quite happy with the MacPyMOL 
version on my iBook, which seems to be subjectively a little bit faster 
than the X11 version (via fink). Make sure that you have enough memory 
(at least 512 MB), otherwise this will be the bottleneck. Maybe, you 
find among your colleages somebody who owns an iBook and try your pymol 
tasks there?


Best regards,

Dirk Kostrewa.

Luca Fenu wrote:


Hi everyone,

I'm thinking of buying a Mac mini to use as minimal computer for home, 
and will need it to run pymol smoothly. is this the case, or the 
little machine doesn't have enough juice to handle, let's say, 
visualisation of a protein active site and ligand docked into it, with 
different level of transparence and such? I need pymol essentially to 
look at my structure and generate pretty pictures for my phD thesis... 
many thanks to anyone can give insights...


   luca




--


Dirk Kostrewa
Paul Scherrer Institut
Life Sciences, OFLC/110
CH-5232 Villigen PSI, Switzerland
Phone:  +41-56-310-4722
Fax:+41-56-310-5288
E-mail: dirk.kostr...@psi.ch
http://sb.web.psi.ch





RE: [PyMOL] Pymol on MacMini: performances

2005-06-15 Thread Einat Sitbon


Hi Luca,
I'm using MacPymol on an old blue and white G3, and it works fine.

Einat


To reply, please change the mmm in the reply-to address to hotmail

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RE: [PyMOL] Pymol on MacMini: performances

2005-06-15 Thread Warren DeLano
Luca,

We bought a Mini here in the office to use as an inexpensive, secure,
stable, & hassle-free CVS server.  I hadn't tried running PyMOL on it until
today...

In a very small set of tests with surfaces, a $600 1.42 Ghz G4 Mini (ATI)
has about 25% of the OpenGL performace and 60% of the ray-tracing
performance of a $1800 1.8 Ghz iMac G5 (nVidia).  For comparison, a $450
eMachines 2.8 Ghz Celeron (Intel Graphics) has about 80% of the OpenGL
performace and 40% of the ray-tracing performance of the iMac.

In other words, the Mini's CPU performance is great; the graphics
performance isn't.  However, if you just stick to displaying lines, then the
Mini does very well -- as good as the iMac.  You can display transparent
surfaces of active sites just fine, but complete protein surfaces will seem
rather slow.

512 MB RAM is a minimum recommendation for ray-tracing with PyMOL. 784MB or
1GB is better.

Cheers,
Warren

--
Warren L. DeLano, Ph.D. 
Principal Scientist

. DeLano Scientific LLC  
. 400 Oyster Point Blvd., Suite 213   
. South San Francisco, CA 94080 USA   
. Biz:(650)-872-0942  Tech:(650)-872-0834 
. Fax:(650)-872-0273  Cell:(650)-346-1154
. mailto:war...@delsci.com  
 

> -Original Message-
> From: pymol-users-ad...@lists.sourceforge.net 
> [mailto:pymol-users-ad...@lists.sourceforge.net] On Behalf Of 
> Luca Fenu
> Sent: Tuesday, June 14, 2005 10:25 AM
> To: pymol-users@lists.sourceforge.net
> Subject: [PyMOL] Pymol on MacMini: performances
> 
> Hi everyone,
> 
> I'm thinking of buying a Mac mini to use as minimal computer 
> for home, and will need it to run pymol smoothly. is this the 
> case, or the little machine doesn't have enough juice to 
> handle, let's say, visualisation of a protein active site and 
> ligand docked into it, with different level of transparence 
> and such? I need pymol essentially to look at my structure 
> and generate pretty pictures for my phD thesis... many thanks 
> to anyone can give insights...
> 
> luca
> --
> S for stupendous! T for Tiger, ferocity of! U for Underwear, 
> red! P for Power, incredible! E for Excellent physique! N for 
> ...um... something... 
> hmm, well I'll come back to that... D for Determination! U.. for... 
> wait, how do you spell this? Is it 'I'?
> 
> 
> 
> ---
> SF.Net email is sponsored by: Discover Easy Linux Migration 
> Strategies from IBM. Find simple to follow Roadmaps, 
> straightforward articles, informative Webcasts and more! Get 
> everything you need to get up to speed, fast. 
> http://ads.osdn.com/?ad_id=7477&alloc_id=16492&op=click
> ___
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> https://lists.sourceforge.net/lists/listinfo/pymol-users
> 





Re: [PyMOL] Pymol on MacMini: performances

2005-06-16 Thread Moriarty, Daniel
Luca,

I've been using a eMac with similar specs to the MacMini and it works fine.
The only major change I see between the G5 in my lab and the eMac at home is
the surface calculations and ray tracing.  For what you want, my guess is it
will be fine.

Dan

--
Dr. Daniel Moriarty
Siena College
Chemistry and Biochemistry Dept.
515 Loudon Road
Loudonville, NY 12211
(518) 783-2472
fax: (518) 276-4887

> From: Luca Fenu 
> Organization: university of southampton
> Reply-To: 
> Date: Tue, 14 Jun 2005 17:24:32 +
> To: 
> Subject: [PyMOL] Pymol on MacMini: performances
> 
> Hi everyone,
> 
> I'm thinking of buying a Mac mini to use as minimal computer for home,
> and will need it to run pymol smoothly. is this the case, or the little
> machine doesn't have enough juice to handle, let's say, visualisation of
> a protein active site and ligand docked into it, with different level of
> transparence and such? I need pymol essentially to look at my structure
> and generate pretty pictures for my phD thesis... many thanks to anyone
> can give insights...
> 
> luca
> -- 
> S for stupendous! T for Tiger, ferocity of! U for Underwear, red! P for
> Power, incredible! E for Excellent physique! N for ...um... something...
> hmm, well I'll come back to that... D for Determination! U.. for...
> wait, how do you spell this? Is it 'I'?
> 
> 
> 
> ---
> SF.Net email is sponsored by: Discover Easy Linux Migration Strategies
> from IBM. Find simple to follow Roadmaps, straightforward articles,
> informative Webcasts and more! Get everything you need to get up to
> speed, fast. http://ads.osdn.com/?ad_id=7477&alloc_id=16492&op=click
> ___
> PyMOL-users mailing list
> PyMOL-users@lists.sourceforge.net
> https://lists.sourceforge.net/lists/listinfo/pymol-users




Re: [PyMOL] Pymol on MacMini: performances

2005-06-15 Thread Konrad . Hinsen

On Jun 15, 2005, at 9:13, Luca Fenu wrote:

I thought so, but couldn't be sure, as a lot depends on the quality of 
the drivers... w/o Direct Rendering (ATI drivers sucks!), my ath64 
laptop with R9700 only manages to give me some 4 fps... that makes it 
all but unusable. so i was afraid to find myself in an even worst 
situation... Hopefully, PyMol takes advantage of Altivec... I'll give 
it a try. thanks again...


There's no Altivec in the G4 processor that drives the mac mini.

Apple has always had good graphics drivers, I wouldn't worry about 
that. My iBook (whose hardware is very similar to the mini) has much 
better PyMol performance than some of my Linux boxes whose hardware 
(both CPU and graphics) is more powerful in theory.


However, nothing beats real-life experience. Pack PyMOL and your data 
on a CD and go visit your nearest Apple vendor!


Konrad.
--
-
Konrad Hinsen
Laboratoire Léon Brillouin, CEA Saclay,
91191 Gif-sur-Yvette Cedex, France
Tel.: +33-1 69 08 79 25
Fax: +33-1 69 08 82 61
E-Mail: khin...@cea.fr
-




RE: [PyMOL] Pymol on MacMini: performances

2005-06-17 Thread Warren DeLano
> There's no Altivec in the G4 processor that drives the mac mini.

According to Apple, the mini's do have a "Velocity Engine" aka Altivec.  
However, PyMOL doesn't itself use it, though we seriously considering writing 
some Ativec code for MacPyMOL back when the G5 came out.  With Apple now going 
to Intel chips, I'm glad now that we didn't waste our time on that.

--
Warren L. DeLano, Ph.D. 
Principal Scientist

. DeLano Scientific LLC  
. 400 Oyster Point Blvd., Suite 213   
. South San Francisco, CA 94080 USA   
. Biz:(650)-872-0942  Tech:(650)-872-0834 
. Fax:(650)-872-0273  Cell:(650)-346-1154
. mailto:war...@delsci.com  
 

> -Original Message-
> From: pymol-users-ad...@lists.sourceforge.net 
> [mailto:pymol-users-ad...@lists.sourceforge.net] On Behalf Of 
> konrad.hin...@cea.fr
> Sent: Friday, June 17, 2005 9:14 AM
> To: l.a.f...@soton.ac.uk
> Cc: pymol-users@lists.sourceforge.net
> Subject: Re: [PyMOL] Pymol on MacMini: performances
> 
> On Jun 15, 2005, at 9:13, Luca Fenu wrote:
> 
> > I thought so, but couldn't be sure, as a lot depends on the 
> quality of 
> > the drivers... w/o Direct Rendering (ATI drivers sucks!), my ath64 
> > laptop with R9700 only manages to give me some 4 fps... 
> that makes it 
> > all but unusable. so i was afraid to find myself in an even worst 
> > situation... Hopefully, PyMol takes advantage of Altivec... 
> I'll give 
> > it a try. thanks again...
> 
> There's no Altivec in the G4 processor that drives the mac mini.
> 
> Apple has always had good graphics drivers, I wouldn't worry 
> about that. My iBook (whose hardware is very similar to the 
> mini) has much better PyMol performance than some of my Linux 
> boxes whose hardware (both CPU and graphics) is more powerful 
> in theory.
> 
> However, nothing beats real-life experience. Pack PyMOL and 
> your data on a CD and go visit your nearest Apple vendor!
> 
> Konrad.
> --
> -
> Konrad Hinsen
> Laboratoire Léon Brillouin, CEA Saclay,
> 91191 Gif-sur-Yvette Cedex, France
> Tel.: +33-1 69 08 79 25
> Fax: +33-1 69 08 82 61
> E-Mail: khin...@cea.fr
> -
> 
> 
> 
> ---
> SF.Net email is sponsored by: Discover Easy Linux Migration 
> Strategies from IBM. Find simple to follow Roadmaps, 
> straightforward articles, informative Webcasts and more! Get 
> everything you need to get up to speed, fast. 
> http://ads.osdn.com/?ad_idt77&alloc_id492&op=ick
> ___
> PyMOL-users mailing list
> PyMOL-users@lists.sourceforge.net
> https://lists.sourceforge.net/lists/listinfo/pymol-users
> 
> 
>