[PyMOL] refresh molecule display in python script

2011-09-14 Thread Matthias Schmidt
Hi, I am loading a pdb file in a python script for pymol. The script has the following structure: def script do something cmd.load(file.pdb) do lot more cmd.extend(script, script) When the python script is completed, the molecule file.pdb is shown in the openGL display, but not before. How

Re: [PyMOL] refresh molecule display in python script

2011-09-14 Thread Thomas Holder
Hi Matthias, use spawn instead of run. http://pymolwiki.org/index.php/Fork Cheers, Thomas On 09/14/2011 02:30 PM, Matthias Schmidt wrote: Hi, I am loading a pdb file in a python script for pymol. The script has the following structure: def script do something cmd.load(file.pdb) do

Re: [PyMOL] refresh molecule display in python script

2011-09-14 Thread Андрей Гончар
Try to do the following: in your script.py from pymol import cmd cmd.load(file.pdb) def script(): do something... cmd.extend(script, script) In this case your pdb will be loaded before the script completes. 2011/9/14 Thomas Holder spel...@users.sourceforge.net: Hi Matthias, use spawn

Re: [PyMOL] refresh molecule display in python script

2011-09-14 Thread Андрей Гончар
So what exactly do you want your script to do? 1. Show loaded file 2. Modify file 3. Show modified file Is it right? 2011/9/14 Matthias Schmidt matthias.rene.schm...@gmail.com: Hi, This approach does not work, because file.pdb is written in do something... Also, if I say spawn script.py

[PyMOL] Slicing a protein (PDB Structure)

2011-09-14 Thread Spyros Charonis
Hello PyMOLers, I have a GPCR protein molecule (pdb file) whose structure I would like to visualize, but instead of seeing the entire structure as one entity, I would like to separate it, somehow as if I was using an imaginary plane to chop the protein into two entities (extracellular interface,

Re: [PyMOL] movie enhancement feature request...

2011-09-14 Thread Michael Zimmermann
Hello Tim, It sounds like a combination of mview store (saving your scenes) and mview reinterpolate (interpolating between them) is what you are looking for. http://www.pymolwiki.org/index.php/MovieSchool_4 Unless you mean interpolating between different representations of your structure. Could

Re: [PyMOL] movie enhancement feature request...

2011-09-14 Thread Jason Vertrees
Hi Tim, I love pymol for creating high quality figures and analysing my structures. But creating movies in pymol is rather tedious... CCP4mg seems to be much easier to use for creating movies, you just have to save a scene and CCP4mg interpolates between the created scenes. Is there a plan

Re: [PyMOL] movie enhancement feature request...

2011-09-14 Thread Tim Schulte
Yes, that is exactly what I wanted. Perfect. Thank you very much. Am 9/14/11 5:59 PM, schrieb Jason Vertrees: Hi Tim, I love pymol for creating high quality figures and analysing my structures. But creating movies in pymol is rather tedious... CCP4mg seems to be much easier to use for

Re: [PyMOL] Slicing a protein (PDB Structure)

2011-09-14 Thread Jason Vertrees
Hi Spyros, This can be done pretty easily in PyMOL. Please check out the following: Plane Wizard: * -- http://www.pymolwiki.org/index.php/Plane_Wizard; BNI-tools Plane Wizard * -- http://sourceforge.net/projects/bni-tools/ Section 2.6 of the supplemental information to our PLoS paper * --

Re: [PyMOL] movie enhancement feature request...

2011-09-14 Thread Brian Mark
Hello everyone, Speaking of movies, is there a way to control the fade-in and fade-out rate of objects between scenes (eg. by changing the value of the transparency variable over a series of frames perhaps) using the native pymol movie features? Kristian Rother wrote a great movie script a

Re: [PyMOL] movie enhancement feature request...

2011-09-14 Thread Jason Vertrees
Hi Brian, Speaking of movies, is there a way to control the fade-in and fade-out rate of objects between scenes (eg. by changing the value of the transparency variable over a series of frames perhaps) using the native pymol movie features?  Kristian Rother wrote a great movie script a

Re: [PyMOL] refresh molecule display in python script

2011-09-14 Thread Андрей Гончар
So I've tryed to use cmd.refresh() and it has worked! So your script must include the following: cmd.load cmd.refresh [some actions] cmd.load cmd.refresh [some actions] etc. 2011/9/14 Matthias Schmidt matthias.rene.schm...@gmail.com: Hi, not quite the script does the following: 1: load a file

[PyMOL] how do I quick know the default value setting

2011-09-14 Thread lina
Hi, when I tried to set something, let's say set stick_radius, 0.5 found not ideal, and I wanna be back to default setting, how do I check the default settings very quickly. above just an example, not real case, Thanks for any suggestions, -- Best Regards, lina

Re: [PyMOL] how do I quick know the default value setting

2011-09-14 Thread Tsjerk Wassenaar
Hi Lina, In most cases, you can set it back to default by setting it to -1. To know what the default value is, you can use 'get setting_name', before you start fiddling with the setting. Hope it helps, Tsjerk On Sep 15, 2011 4:12 AM, lina lina.lastn...@gmail.com wrote: Hi, when I tried to