[PyMOL] assigning properites

2006-05-23 Thread Frank Murphy

Hello,

I was wondering if anyone out there has connived a way to assign 
different properties to different objects (properties that are normally 
universal)?


For example, setting cartoon_trace to different values so one could draw 
cartoons for CA-only and full atomic models in the same session.


Thanks in advance,

Frank
Long time listener, 1st time poster

--
Frank Murphy

MRC LMB
Structural Studies Division
Hills Road
Cambridge CB2 2QH

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Re: [PyMOL] assigning properites

2006-05-23 Thread Tsjerk Wassenaar

Hi Frank,

These settings apply to objects, if specified.

set cartoon_trace,1,object1

will make it apply only to object1

Cheers,

Tsjerk

On 5/23/06, Frank Murphy f...@mrc-lmb.cam.ac.uk wrote:


Hello,

I was wondering if anyone out there has connived a way to assign
different properties to different objects (properties that are normally
universal)?

For example, setting cartoon_trace to different values so one could draw
cartoons for CA-only and full atomic models in the same session.

Thanks in advance,

Frank
Long time listener, 1st time poster

--
Frank Murphy

MRC LMB
Structural Studies Division
Hills Road
Cambridge CB2 2QH

LAB  +44 1223 402295
MOB +44 7779 224206
FAX   +44 1223 213556
SKYPE frankvmurphy



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--

Tsjerk A. Wassenaar, M.Sc.
Groningen Biomolecular Sciences and Biotechnology Institute (GBB)
Dept. of Biophysical Chemistry
University of Groningen
Nijenborgh 4
9747AG Groningen, The Netherlands
+31 50 363 4336


[PyMOL] Is there any way to show the coordinates?

2006-05-23 Thread Ronald Chiu

Hello All,

Is there any way to show the coordinates for the orientation that a protein
is in?
Lets say you tweak (rotate and turn) a protein in to a particular
orientation, is there any way to tell pymol to display the coorindates for
that orientation.  So that you could just manually input those coordinates
and have pymol automatically orient the protein to return to that
orientation.

Thanks for your help.

Ron


Re: [PyMOL] Is there any way to show the coordinates?

2006-05-23 Thread Tsjerk Wassenaar

Hi Ron,

Check the commands

get_view
set_view

Cheers,

Tsjerk

On 5/23/06, Ronald Chiu rccom...@gmail.com wrote:


Hello All,

Is there any way to show the coordinates for the orientation that a
protein is in?
Lets say you tweak (rotate and turn) a protein in to a particular
orientation, is there any way to tell pymol to display the coorindates for
that orientation.  So that you could just manually input those coordinates
and have pymol automatically orient the protein to return to that
orientation.

Thanks for your help.

Ron





--

Tsjerk A. Wassenaar, M.Sc.
Groningen Biomolecular Sciences and Biotechnology Institute (GBB)
Dept. of Biophysical Chemistry
University of Groningen
Nijenborgh 4
9747AG Groningen, The Netherlands
+31 50 363 4336


[PyMOL] alternate conformations

2006-05-23 Thread Nguyen, Tina (GSBS)
Hi,
 
I would like to represent my alternate conformations by showing one
residue in dashed sticks and the other in solid sticks. Can anyone help
me with that?
 
Tina Nguyen
 
Graduate Student
University of Massachusetts Medical School
 


RE: [PyMOL] biological unit

2006-05-23 Thread Zheng Yang
Hi Jacob,

Thank you so much for your reply! 

Actually, I want to show how the virus HK97 evolve from Prohead (PDB ID: 1if0)
to Head (PDB ID: 1ohg) state. There are some intermediate states from our
calculation. All the PDB files are Biological Unit files. 

However, if you load a biological unit file to PyMOL, it will be put into
separated states/frames. By applying the command, 'split_states', to the first
PDB file, [1if0.pdb1], you will get a series of objects, e.g.:
1if0_0001
1if0_0002
1if0_0003
..
1if0_0060

After that if you now load the second PDB file, [1ohg.pdb1], and split it, you
will get more objects:
1ohg_0001
1ohg_0002
..
1ohg_0060

All the above objects appear in the same state/frame. But we want to put the
N'th file to the N'th frame. Is there an easy way to put the second Biological
Unit PDB file to next states/frame? 

Thank you all! 

Best,
Zheng 


-Original Message-
From: Jacob Corn [mailto:jc...@berkeley.edu] 
Sent: Tuesday, May 23, 2006 11:12 AM
To: proteiny...@gmail.com
Subject: Re: [PyMOL] biological unit

Hi Zheng,
Sorry it's taken me a while to get back to you. I'm not entirely clear 
on your question. Precisely what is it that you're trying to do with the 
movie?
I don't think split_states has an option to keep some of the states as 
separate states while splitting others, if that's what you're asking. 
You could split everything and then write a script to use only certain 
of those resulting models in the movie.

Zheng Yang wrote:
 Dear all,
 
 I want to create a movie of a virus capsid from N biological unit pdb files
 (N frames). After loading and splitting the first pdb file, how to load the
 remaining pdb files and put them in different states/frames? 
 
 Is there any optional control on the command, 'split_states', e.g. splitting
 to a certain state? 
 
 Thanks a lot!
 Zheng 
 
 -Original Message-
 From: pymol-users-ad...@lists.sourceforge.net
 [mailto:pymol-users-ad...@lists.sourceforge.net] On Behalf Of Jacob Corn
 Sent: Sunday, May 21, 2006 1:58 AM
 To: surendra negi
 Cc: PyMOL-users@lists.sourceforge.net
 Subject: Re: [PyMOL] biological unit
 
 Hi Surendra,
 Just to make sure, are you downloading the biological unit PDB from 
 RCSB? That should be a 5MB gzipped file. The normal PDB for 1c8e does 
 not contain coordinates for the biological unit (which you need to use 
 split_states); only a monomer and then info on crystal symmetry. If you 
 go to a PDB entry at the RCSB and open up the Download Files menu, 
 choose the last option in the list, Biological Unit Coordinates.
 Here is a direct link to the biological unit for 1c8e
 http://www.rcsb.org/pdb/files/1c8e.pdb1.gz
 The normal PDB is
 http://www.rcsb.org/pdb/files/1c8e.pdb.gz
 
 Jacob
 
 surendra negi wrote:
 Ji Jacob,
  I am trying to produce the results  shown in 

 http://delsci.com/img/1c8e.jpg
 http://delsci.com/img/1c8e-screen.jpg

 using 


 split_states 1c8e
 delete 1c8e
 zoom
 spectrum b
 hide lines
 set cartoon_sampling,3
 show cartoon
 bg_color grey70
 set hash_max, 150
 ray
 orient
 zoom complete=1
 ray
 script in my linux machine but is is not working and
 also giving no error message. It is just showing me
 single molecule. Do you have any suggestions.
 thanks
 surendra

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Re: [PyMOL] alternate conformations

2006-05-23 Thread Robert Immormino

Tina,

A work-around that does something like what you are looking for is:

load protein_with_alts.pdb, A
load protein_with_alts.pdb, B
hide everything,
show sticks, A and alt A
show sticks, B and alt B
set stick_ball, 1, B
set stick_overlap, -1.8, B

Cheers,

-bob

On 5/23/06, Nguyen, Tina (GSBS) tina.ngu...@umassmed.edu wrote:





Hi,



I would like to represent my alternate conformations by showing one residue
in dashed sticks and the other in solid sticks. Can anyone help me with
that?



Tina Nguyen



Graduate Student

University of Massachusetts Medical School






[PyMOL] AMD64 X2+Quadro FX1300+Fedora5

2006-05-23 Thread Ricardo Aparicio

Dear all,

I thought to be worth posting this message for those who experience 
problems with dual core+quadro FX.

It seems that only recently kernel and compatible driver became available.

We succeeded installing PyMOL in a AMD64 X2+Quadro FX1300+Fedora5.
After installing Fedora 5 (which seems to recognize FX1300 automatically 
but without working properly),
we followed a recipe (2-May-2006) from http://www.fedorafaq.org/  
(Problems and Their Solutions, Q3)


We used yum install kmod-nvidia (yum install kmod-nvidia-smp  
did not work)


Kernel 2.6.16-1.2122_FC5  was installed by this last command line.
(21-May-2006 -
http://download.fedora.redhat.com/pub/fedora/linux/core/updates/5/i386/)

After that, we have followed the rest of the recipe and changed  
/etc/X11/xorg.conf   (Driver  nvidia)


PyMOL 0.99 runs beautifully although stereo mode was not tested yet.

Kind regards,


Ricardo Aparicio
http://www.iqm.unicamp.br/profs/aparicio.html






[PyMOL] label in Greek letters

2006-05-23 Thread Takatoshi Arakawa
Hi All users,
I am a PyMOL ver.0.99rc6 (Win and Linux) user.
Now I want to label with chain ID ( A, B, G,... for alpha, beta,
gamma,...) in Greek letters.
I have tried it following
http://www.pymolwiki.org/index.php/Label#UTF8_Fonts , but the output
corresponds to \316\261 has not been printed.
Please give me some advice about this and tell me any other ways to do.

Thank you,

Arakawa





[PyMOL] Runtime Error

2006-05-23 Thread Zheng Yang
Dear All,

Does anyone have the same runtime error, by applying the command, [ray] or
[show surface], on big size protein, e.g. 1AON, etc? 

PyMOL Version: 0.99
System: Dell 9100
OS: Windows XP + SP2
CPU: Intel P4 3.0G
RAM: 1.5G
Video Card: nVidia GeForce 6800, 256M

Thanks,
Zheng 
attachment: Runtime Error.jpg