Re: [PyMOL] uninstall plugins?

2008-09-14 Thread DeLano Scientific
Sure. Done. It is now in the open-source code, and it will be present in version 1.2 builds. -Original Message- From: pymol-users-boun...@lists.sourceforge.net [mailto:pymol-users-boun...@lists.sourceforge.net] On Behalf Of Matthew O'Meara Sent: Thursday, September 11, 2008 10:24 AM To

Re: [PyMOL] I want to represent a domain of my molecule as a lowresolution solid shape

2008-09-14 Thread DeLano Scientific
Pietro, Below is an example script demonstrating how to create low-resolution structure "blobs" using PyMOL: load $TUT/1hpv.pdb, inp remove not polymer alter all, b=50 alter all, q=1 set gaussian_resolution,4 map_new mapA, gaussian, 1, inp and chain A, 6 isosurface surfA, mapA set gaussian_res

Re: [PyMOL] Launch parameter "-d" with string

2008-09-14 Thread DeLano Scientific
Christian, That limitation was fixed ages ago, spaces in commands such as: ./pymol -d 'help selections' should work fine with any recent unix-based PyMOL build, open-source or commercial. Cheers, Warren -- DeLano Scientific LLC Subscriber Support Services mailto:supp...@delsci.com -Origin

Re: [PyMOL] Mutate serine to phosphoserine?

2008-09-14 Thread DeLano Scientific
Ben, P-Ser and P-Try aren't currently built in to PyMOL. You could of course build the chemistry up atom by atom using the builder, but the resulting atom names wouldn't match standard PDB conventions. Cheers, Warren -- DeLano Scientific LLC Subscriber Support Services mailto:supp...@delsci

Re: [PyMOL] select residues/atoms

2008-09-14 Thread DeLano Scientific
Rens, All atoms should be clickable, provided that you're displaying one of the clickable representations: lines, spheres, sticks, ribbon, label, cartoon, nonbonded, and nb_spheres. If it isn't working, then there could be an issue with the graphics card. Be sure to check that you are running in