[PyMOL] how to remove incomplete residues from an atom selection?

2015-02-17 Thread Jose Borreguero
o the selection. Can anyone help me out, please? Best, Jose Borreguero -- Download BIRT iHub F-Type - The Free Enterprise-Grade BIRT Server from Actuate! Instantly Supercharge Your Business Reports and Dashboards with Interact

[PyMOL] How to show atom index or atom serial when clicking on an atom?

2014-07-13 Thread Jose Borreguero
Dear pymol users, When I click in an atom (mouse->selection mode->atoms) I get the /chain_name/residue_name/atom_name info string. Is there a way to output the atom serial or atom index? My molecule has atoms with duplicate names within the same residue, so the info string chain_name/residue_name/

Re: [PyMOL] how to select whole residues around an object?

2012-02-20 Thread Jose Borreguero
Whoohoo! it works like a charm. Thank you :D On Mon, Feb 20, 2012 at 2:41 PM, João Rodrigues wrote: > Use byres(). > > select neighbours, byres( chain A w. 4A of chain B) > > Cheers, > > João > -- Try before you buy =

[PyMOL] how to select whole residues around an object?

2012-02-20 Thread Jose Borreguero
Selection 'X around 4.0' selects all atoms within 4.0 of object/selection X. However, how do I select all residues within 4.0 of X? The condition I need is that if at least one atom of residue Y is within 4.0 of X, then all the atoms of Y are to be selected. How do I express this condition with the

[PyMOL] drawing a cloud of points?

2010-05-09 Thread Jose Borreguero
Dear Pymol users, I want to draw a cloud of points aroud a particular atom, provided I have the coordinates for each point of the cloud. How can I do this? -Jose -- ___ PyMOL-u

[PyMOL] Help! "from pymol import cmd" pops up unwanted GUI

2008-07-02 Thread Jose Borreguero
I am rather new to pymol. Now, I want to use it as a module withing a python script but importing the module brings up the GUI when I execute the script. See below the toy script: #!/usr/bin/python from pymol import cmd cmd.load('foo.pdb') This script, when executed in my machine, will pop up the

[PyMOL] thick c-alpha trace?

2006-02-16 Thread Jose Borreguero
I have a pdb with only CA entries. I did "set ribbon_trace,1" and "show ribbon" to see the c-alpha trace, but is there a way to control the thickness of the lines connecting the CA's ? jose