Re: [PyMOL] Access API without the GUI

2014-11-11 Thread V.V.
Hi Doug, Please see the batch mode option: http://www.pymolwiki.org/index.php/Command_Line_Options I ran into some issues under Win (http://www.mail-archive.com/pymol-users@lists.sourceforge.net/msg12855.html), but it works fine on my Ubuntu. Vitaly On Tue, Nov 11, 2014 at 1:56 PM, Douglas Houst

[PyMOL] Pymol quits in batch mode

2014-11-06 Thread V.V.
Hi Pymolers, I have some Python script that I would like to run on Pymol in the batch mode. To do this, I have written a "startup.py" script which I call from Python. The script is supposed to launch Pymol and run it in the batch mode with the "work.py" script. However, once I execute it, Pymol qu

[PyMOL] Dynoplot from the command line

2014-04-22 Thread V.V.
Hi, After installing Dynoplot I was able to start it via the plugins menu (which works fine), but when I try starting it via the command line it throws an error (please see the log file). Eventually I'd like to use Dynoplot in combination with "Monitor file continuously" one to visualize the outp

Re: [PyMOL] Lighting script request

2013-02-18 Thread V.V.
ular light > > set edit_light, 2 > > Now, in 3-button Lights mode, the mouse will move light 2. > > The default light is ambient which cannot be moved. If you have 3 lights on > (ambient and two specular), then you can move the two specular two lights by > setting edit_l

[PyMOL] Lighting script request

2013-02-16 Thread V.V.
Occasionally I need to play around with the number of lights and their vectors to get nice rendering. It's not something I do often, so every time I need to scour through the mailing list to recall Pymol definitions of light sources (the page on "light" badly needs updating). So... Can someone writ

[PyMOL] Delete empty objects

2012-12-11 Thread V.V.
Hello, Is there a quick way to delete the objects that do not contain any atoms? Thank you in advance, Vitaly -- LogMeIn Rescue: Anywhere, Anytime Remote support for IT. Free Trial Remotely access PCs and mobile devices a

Re: [PyMOL] Saving a single state from scene

2012-06-23 Thread V.V.
ate to a pdb: > > save ~/state5.pdb, my_object, 5 > > Why are you deleting objects instead of hiding them (using scenes)? > Name collisions? Something else? > > Cheers, > > -- Jason > > On Mon, Jun 18, 2012 at 2:40 PM, V.V. wrote: >> Hello, >> >>

[PyMOL] Saving a single state from scene

2012-06-18 Thread V.V.
Hello, I have a 60-state session file that contains three objects: one of them has a single state, while other two have several. In the first state of the session objects #1 and #2 are loaded, and halfway through object #2 is deleted and object #3 is loaded. Is it possible to save the individual s

Re: [PyMOL] Changing camera view during trajectory playback

2012-05-16 Thread V.V.
t; >> mview store, scene=001 >> >> >> Add various scenes at various frames and PyMOL will interpolate >> movement and representations for you. >> >> Cheers, >> >> -- Jason >> >> >> On Wed, May 16, 2012 at 7:41 AM, V.V.  wro

[PyMOL] Changing camera view during trajectory playback

2012-05-15 Thread V.V.
Hello, Is there a way in Pymol to combine the trajectory with the camera movement? I load the trajectory, which is a pdb file where each conformation is represented as a model entry, and call pml script with the view adjustment commands. If I call the following snippet, the view is set to "YYY" th

Re: [PyMOL] Extracting Scene Info

2012-04-12 Thread V.V.
Hello, I have an old session file, and I would like to extract the color information of certain objects in it. I use print cmd.get_session()['names'] to get the scene information, but which values in the output arrays contain the information about the color? Thank you, Vitaly On Tue, Feb 21, 201

Re: [PyMOL] pymol custom startup

2011-02-15 Thread V.V.
There may be a better way of doing this, but I would put the "hide all" and "show spheres" commands you mention in a script file and call it after loading the structure. Vitaly On Tue, Feb 15, 2011 at 21:29, John Russo wrote: > Hi to all, > I have a simple question but I've googled extensively