Re: [PyMOL] cartoon_sidechain_helper

2011-11-14 Thread Justin Lecher
Strange, yesterday I did a quick test and it didn't work. But here on my
main machine everything is fine.
Sorry for the noice.

jsutin


On 13/11/11 17:48, Jason Vertrees wrote:
 Hi Justin,
 
 It works; see 
 http://www.pymolwiki.org/index.php/File:Cartoon_side_chain_helper_on.png.
 You just have to color by atom type after coloring by secondary
 structure:
 
 set cartoon_sidechain_helper, on
 
 C  Color  by ss  Helix (red) Sheet (yellow) Loop (green)
 
 C  Color  by element  ...
 
 Cheers,
 
 -- Jason
 
 On Sun, Nov 13, 2011 at 7:11 AM, Justin Lecher j.lec...@fz-juelich.de wrote:
 Hi,

 while trying this

 http://kpwu.wordpress.com/2011/11/12/pymol-sidechain-helper-in-the-cartoon-view/

 I recognised that the color by atom type function doesn't work anymore
 if the sidechain helper is on. Bug or feature? Could we enable it?

 Thanks justin

 --
 Justin Lecher
 Institute of Complex Systems
 ICS-6 Structural Biochemistry
 Research Centre Juelich
 52425 Juelich, Germany
 phone: +49 2461 61 2117



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ICS-6 Structural Biochemistry
Research Centre Juelich
52425 Juelich, Germany
phone: +49 2461 61 2117




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[PyMOL] Create a dummy atom

2011-11-14 Thread ABEL Stephane 175950
Dear all, 

I have a simple question but i have found no response: i have downloaded a 
pymol script COM.py from the pymol wiki to obtain the coordinates x, y and z of 
the center of mass of my protein. Now i would like to create a dummy at these 
coordinates. How to do that with pymol ?

Thank for your help

Stephane
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Re: [PyMOL] Create a dummy atom

2011-11-14 Thread Troels Emtekær Linnet
Using pseudo atoms

http://www.pymolwiki.org/index.php/Pseudoatom

using pos=


pseudoatom tmpPoint2, resi=40, chain=ZZ, b=40, color=tv_blue, pos=[-10, 0, 10]


Troels Emtekær Linnet
Slotsvej 2
4300 Holbæk
Mobil: +45 60210234



2011/11/14 ABEL Stephane 175950 stephane.a...@cea.fr

 Dear all,

 I have a simple question but i have found no response: i have downloaded a
 pymol script COM.py from the pymol wiki to obtain the coordinates x, y and
 z of the center of mass of my protein. Now i would like to create a dummy
 at these coordinates. How to do that with pymol ?

 Thank for your help

 Stephane

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Re: [PyMOL] Create a dummy atom

2011-11-14 Thread Jason Vertrees
Stephane,

Create a psuedoatom and specify the coordinates:

pseudoatom myCentralAtom, pos=[X,Y,Z]

pseudoatom myCentralAtom, pos=[10.20, -14.2, 0.44]

Cheers,

-- Jason

On Mon, Nov 14, 2011 at 4:33 PM, ABEL Stephane 175950
stephane.a...@cea.fr wrote:
 Dear all,

 I have a simple question but i have found no response: i have downloaded a 
 pymol script COM.py from the pymol wiki to obtain the coordinates x, y and z 
 of the center of mass of my protein. Now i would like to create a dummy at 
 these coordinates. How to do that with pymol ?

 Thank for your help

 Stephane
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-- 
Jason Vertrees, PhD
PyMOL Product Manager
Schrodinger, LLC

(e) jason.vertr...@schrodinger.com
(o) +1 (603) 374-7120

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[PyMOL] Create a dummy atom

2011-11-14 Thread ABEL Stephane 175950
Thank you Jason and Troels for your quick response. 

I have an additional question. Now if i want to pass the COM coordinates x, y 
and z obtained with the COM script  in the pseudoatom pos. For example to use 
in the script

How i can do that ?

Thank you again for your response.

Stephane
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Re: [PyMOL] Create a dummy atom

2011-11-14 Thread Jason Vertrees
Stephane,

COM should return the coordinates:

theCenter = COM(...)
pseudoatom theAtom, pos=theCenter

Cheers,

-- Jason

On Mon, Nov 14, 2011 at 5:44 PM, ABEL Stephane 175950
stephane.a...@cea.fr wrote:
 Thank you Jason and Troels for your quick response.

 I have an additional question. Now if i want to pass the COM coordinates x, y 
 and z obtained with the COM script  in the pseudoatom pos. For example to use 
 in the script

 How i can do that ?

 Thank you again for your response.

 Stephane
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-- 
Jason Vertrees, PhD
PyMOL Product Manager
Schrodinger, LLC

(e) jason.vertr...@schrodinger.com
(o) +1 (603) 374-7120

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