[PyMOL] Re: building peptides

2006-03-15 Thread gilleain torrance
Hi, The wiki has a page on this: http://www.pymolwiki.org/index.php/Peptide_Sequence except it doesn't mention the zwitterion details. There's a link to Robert Campbell's scripts to do this sort of thing, so maybe the answer is there. As for for loops, this is best in a full python script (run

[PyMOL] RE: [ccp4bb]: off-topic: labelling stereo with PyMOL

2006-03-15 Thread Warren DeLano
Isabel, There is a PyMOL-Users mailing list for such questions at http://lists.sourceforge.net/lists/listinfo/pymol-users As for making stereo labels, the latest PyMOL release 0.99rc6 http://delsci.com/rel/099 has variable-size, stereo 3D labels that can be positioning using the mouse (when

Re: : [PyMOL] Surface Vertex Coordinates

2006-03-15 Thread Laurence Pearl
The Povray intermediate file generated when you do 'ray renderer = 1' contains all vertices, normals and colouring information for cartoon and surface object types. However you do need to produce a parsing script to extract these in to a useful form for importing into other programs. Have

Re: : [PyMOL] Surface Vertex Coordinates

2006-03-15 Thread Tim Fenn
On Wed, Mar 15, 2006 at 09:01:19AM -0800, Benjamin Hitz wrote: I am interested in the coordinates of the vertices of the mesh representation of the molecular surface. Is there any method to read them out? Thanks Me too. With coloring and/or other property information as well.