[PyMOL] Help to compile u3d converter - IDTF to U3D on linux 64

2013-03-04 Thread Troels Emtekær Linnet
Dear Pymolers. I am playing around with creating a pdf file with 3 D graphics. I am saving in *idtf* format, which I convert to *u3d, *and then include in pdf through latex. I can do this on windows, but I can't compile IDTFConverter *on linux 64.* I have made this progress

Re: [PyMOL] Help to compile u3d converter - IDTF to U3D on linux 64

2013-03-04 Thread Justin Lecher
On 04/03/13 12:21, Troels Emtekær Linnet wrote: Dear Pymolers. I am playing around with creating a pdf file with 3 D graphics. I am saving in *idtf* format, which I convert to *u3d, *and then include in pdf through latex. I can do this on windows, but I can't compile IDTFConverter *on

[PyMOL] Showing secondary structure of coarse grained protein

2013-03-04 Thread ABEL Stephane 175950
Hello everybody, I have done several MD simulations with the Martini force field of systems that contain a small protein and surfactant with GROMACS. It is possible to show with pymol the secondary structure of the protein with a cartoon representation and the detergent molecules with beads

Re: [PyMOL] Showing secondary structure of coarse grained protein

2013-03-04 Thread Tsjerk Wassenaar
Hi Stephane, You don't have phi/psi angles, so determining secondary structure is a bit problematic. What you can do is draw a trace through the backbone beads and set the secondary structure representation explicitly. You'll have to make sure to exclude connections between chains. set

Re: [PyMOL] [PyMol] How to visualize surface within a given radius

2013-03-04 Thread Yarrow Madrona
Thank you for your help Thomas, Using your settings I get a lot of partial surfaces Showing the surface around the Pocket selection like this: show surface, protein within 0.5 of pocket_selection worked well but I still see a piece of surface that I really don't want to show up. I guess I can

Re: [PyMOL] [PyMol] How to visualize surface within a given radius

2013-03-04 Thread Sampson, Jared
Hi Yarrow - If you add br. to the show surface command, you will get more continuous surfaces, as the selection will be made by residue instead of by atom. show surface, br. protein within 0.5 of pocket_selection If you don't want to show the surface from a particular residue (e.g. if it's

Re: [PyMOL] pymol install

2013-03-04 Thread Jason Vertrees
Hi Yeping, Check out http://www.pymolwiki.org/index.php/Linux_Install#Compile_and_install. Cheers, -- Jason On Mon, Mar 4, 2013 at 8:17 PM, yp sun sunyep...@yahoo.com.cn wrote: Dear pymol users, I try to install pymol in Linux system as following (1) download pymol-v1.5.0.1.tar.bz2 and

Re: [PyMOL] [PyMol] How to visualize surface within a given radius

2013-03-04 Thread Jason Vertrees
Greetings, Please also investigate the following settings: # needs a real atom selection surface_carve_selection # distance from the above selection to cull surfaces surface_carve_cutoff I looked at your data and there is a small problem. You have a few points where one atom is mapped to