[PyMOL] apbs plugin for MacPyMOL?

2008-09-27 Thread Paul Shannon
I've installed apbs and used it from the command line. Now I'd like to run it (more conveniently) as a MacPyMOL plugin. Anybody know how I can set this up? Thanks! - Paul

[PyMOL] cmd equivalent of Display-Sequence On?

2008-09-23 Thread Paul Shannon
How can I turn sequence display on from a pymol script? 'help display' and 'help sequence' got me nothing Thanks! - Paul

[PyMOL] select ATP hetatm?

2008-09-23 Thread Paul Shannon
What command will select a HETATM of ATP? I am looking at 1ATP.pdb, in which the ATP molecule appears as shown below. I found 'select hetatm' but found no way to be more specific, in the spirit of 'select hetatm and name=ATP' Thanks! - Paul HETATM 2937 O2 PO3 E 338 18.820

[PyMOL] export 2 molecules to one pdb file?

2008-08-13 Thread Paul Shannon
Thanks to Warren for setting me straight on independent positioning of molecules. Now I wish to write out the two molecules, together, to one pdb file, as required by RosettaDock. I must be blind. They say: ...from the main menu, File→Export Molecule can be used to write a PDB file

[PyMOL] independent positioning of two proteins, in preparation for RosettaDock?

2008-08-12 Thread Paul Shannon
Hi all, I am brand new to PyMol. I have a model of a kinase, and another of a heptapeptide containing an experimentally derived phosphosite. The RosettaDock documentation suggests: PyMol can be a useful tool to position proteins relative to each other. Use editing mode from the