Re: [PyMOL] density map

2007-12-07 Thread Tsjerk Wassenaar
Hi Steve,

You'll need to provide more information if you want to have a chance on a
helpful thought. Maybe you could link the .pdb file and the .xplor map and
show what O does to it.

Cheers,

Tsjerk

On Dec 7, 2007 3:57 PM, W.M. B.  wrote:

> Hi, All
>
> I'm trying to make a picture of active site with density map. When I
> loaded the pdb and xplor map, I found that map and model are in the diffrent
> position. But in O, they are fine. Would anyone give me a hint how to fix
> it.
>
> Thanks
>
> Steve
>
> -
> SF.Net email is sponsored by:
> Check out the new SourceForge.net Marketplace.
> It's the best place to buy or sell services for
> just about anything Open Source.
> http://sourceforge.net/services/buy/index.php
> ___
> PyMOL-users mailing list
> PyMOL-users@lists.sourceforge.net
> https://lists.sourceforge.net/lists/listinfo/pymol-users
>
>


-- 
Tsjerk A. Wassenaar, Ph.D.
Junior UD (post-doc)
Biomolecular NMR, Bijvoet Center
Utrecht University
Padualaan 8
3584 CH Utrecht
The Netherlands
P: +31-30-2539931
F: +31-30-2537623


Re: [PyMOL] apbs plugin for macpymol

2007-12-07 Thread Andreas Förster
Thanks to Michael and Warren for a quick and correct but somewhat 
baffling solution.  In OSX, one renames an application and it starts up 
looking quite dissimilar from before.  I'm still new to the Gospel 
according to Steve, and I wouldn't mind enlightenment.


In any case, using MacPyMOL as PyMOLHybrid also solves the problem of 
physically separating the viewer from the external gui, without which 
one couldn't fully harness the power of multiple screens.


A side note regarding Michael's instructions:  APBS doesn't require 
fink.  (I haven't even figured out what fink is yet.  Some sort of yum 
for OSX?)  One can just download the Mac OSX binary from WUSTL and 
install it as per default.  Works like a charm, as does APBS itself. 
Much better than on my Fedora 7 system, I'm embarrassed to admit ;-)



Andreas


Michael Lerner wrote:

I would like to use apbs from within PyMOL.  I have downloaded and
installed the latest version of apbs, and apbs_tools.py exists in
$PYMOL_PATH/modules/pmg_tk/startup/.  However, I find no "plugins" entry
in any of the PyMOL menus.


I think that you need to rename the application bundle to
"PyMOLX11Hybrid" in order to use plugins.


Am I blind or daft?  But the question I'd
really like to have answered is how do I get abps to work.


I would suggest

1) register APBS here http://agave.wustl.edu/apbs/download/
2) Install fink ( http://finkproject.org/ ) and then use it to install
apbs (e.g. by typing "fink install apbs" on the command line).

hope that helps,

-michael


I'm using educational MacPyMOL, which "integrates and extends
Open-Source PyMOL 1.0r1".

Thanks.


Andreas





[PyMOL] density map

2007-12-07 Thread W.M. B.
Hi, All

I'm trying to make a picture of active site with density map. When I loaded
the pdb and xplor map, I found that map and model are in the diffrent
position. But in O, they are fine. Would anyone give me a hint how to fix
it.

Thanks

Steve


[PyMOL] Fit sequence to structure with pymol

2007-12-07 Thread DimitryASuplatov
Hello everybody.
Does anybody know how to perform sequence to structure fit with pymol?
For example this feature in swiss-pdb-viewer is called "Fit" or "Magic
fit". So,
1/ Is there a command to fit sequence to pdb&
2/ If yes, could I specify the region to fit on?

Thanks!




Re: [PyMOL] apbs plugin for macpymol

2007-12-07 Thread Michael Lerner
> I would like to use apbs from within PyMOL.  I have downloaded and
> installed the latest version of apbs, and apbs_tools.py exists in
> $PYMOL_PATH/modules/pmg_tk/startup/.  However, I find no "plugins" entry
> in any of the PyMOL menus.

I think that you need to rename the application bundle to
"PyMOLX11Hybrid" in order to use plugins.

> Am I blind or daft?  But the question I'd
> really like to have answered is how do I get abps to work.

I would suggest

1) register APBS here http://agave.wustl.edu/apbs/download/
2) Install fink ( http://finkproject.org/ ) and then use it to install
apbs (e.g. by typing "fink install apbs" on the command line).

hope that helps,

-michael

>
> I'm using educational MacPyMOL, which "integrates and extends
> Open-Source PyMOL 1.0r1".
>
> Thanks.
>
>
> Andreas
>
> -
> SF.Net email is sponsored by:
> Check out the new SourceForge.net Marketplace.
> It's the best place to buy or sell services for
> just about anything Open Source.
> http://sourceforge.net/services/buy/index.php
> ___
> PyMOL-users mailing list
> PyMOL-users@lists.sourceforge.net
> https://lists.sourceforge.net/lists/listinfo/pymol-users
>



-- 
Biophysics Graduate Student
Carlson Lab, University of Michigan
http://www.umich.edu/~mlerner



[PyMOL] apbs plugin for macpymol

2007-12-07 Thread Andreas Förster

Hey all,

I would like to use apbs from within PyMOL.  I have downloaded and 
installed the latest version of apbs, and apbs_tools.py exists in 
$PYMOL_PATH/modules/pmg_tk/startup/.  However, I find no "plugins" entry 
in any of the PyMOL menus.  Am I blind or daft?  But the question I'd 
really like to have answered is how do I get abps to work.


I'm using educational MacPyMOL, which "integrates and extends 
Open-Source PyMOL 1.0r1".


Thanks.


Andreas