[PyMOL] how to use Pymol to align two protein complexes and calculate RMSD

2010-09-09 Thread Li Xue
Hello all, I want to calculate RMSD for my docking protein models. So I have one target model and one docked model. Each model has a larger chain called receptor, and a smaller chain called ligand. The chains in docked model is highly sequentially similar to the corresponding chains in the target

[PyMOL] Warren L. DeLano Memorial PyMOL Open-Source Fellowship

2010-09-09 Thread Jason Vertrees
Dear PyMOL Users, Please join me in congratulating Michael Lerner, PhD, for being awarded the Warren L. DeLano Memorial PyMOL Open-Source Fellowship for 2010--2011. As many of you are undoubtedly aware, Michael developed the APBS plugin for PyMOL. Out of the nearly 11,000 APBS users world-wide, mo

[PyMOL] incorporating a spherical surface in pymol

2010-09-09 Thread SongJianHui
Hi all, I am using pymol to monitor the structure evolution of one protein which could be bound to some fixed points on a spherical surface. However, I have no idea about how to incorporate these active points in pymol. Any suggestion is welcome. Thanks in advance. Cheers, Jay

Re: [PyMOL] saved surface mesh is rotated/translated wrt atomic model

2010-09-09 Thread Raluca Mihaela ANDREI
I use these commands: cmd.reset() cmd.origin(position=[0,0,0]) cmd.center("origin") cmd.move('z',-cmd.get_view()[11]) Raluca On Thu, 09 Sep 2010 12:11:52 -0400 Philip Bransford wrote: > I am using PyMOL to generate a mesh of a protein. My >commands look like > this: > > load prot.pdb > sh

[PyMOL] saved surface mesh is rotated/translated wrt atomic model

2010-09-09 Thread Philip Bransford
I am using PyMOL to generate a mesh of a protein. My commands look like this: load prot.pdb show surface save surf.obj The mesh surf.obj (or surf.wrl) is rotated and translated relative to the atomic coordinates in prot.pdb. Is there some way to prevent this from happening? For my application

[PyMOL] Register For The 17th Annual Tcl/Tk Conference 2010

2010-09-09 Thread Andreas Kupries
17th Annual Tcl/Tk Conference (Tcl'2010) http://www.tcl.tk/community/tcl2010/ October 11 - 15, 2010 Hilton Suites/Conference Center Chicago/Oakbrook Terrace, Illinois, USA Registration for the Conference is open at http://www.tcl.tk/community/tcl2010/reg.html To book a room at the con

Re: [PyMOL] CA trace

2010-09-09 Thread Vitaly Vostrikov
Jason, It was 0.99. I have re-checked using 1.2 and everything is displayed correctly. Sorry about that. Vitaly - Original Message - From: Jason Vertrees Date: Thursday, September 9, 2010 8:57 am Subject: Re: [PyMOL] CA trace Cc: pymol-users@lists.sourceforge.net > Vitaly, > > I just

Re: [PyMOL] CA trace

2010-09-09 Thread Jason Vertrees
Vitaly, I just ran your example and I get two separate chains. What version of PyMOL are you using? Cheers, -- Jason On Thu, Sep 9, 2010 at 12:16 AM, Vitaly Vostrikov wrote: > Hello, > > I would like to show a CA trace for each of the chains in a dimer. The > "cartoon_trace" option works fin