Re: [PyMOL] installation trouble - SOLVED!!!

2006-12-15 Thread Angelo Favia
Hi Warren and all, I finally managed to solve my problem: here'e where I found the inspiration: http://discuss.pcmag.com/forums/1004327277/ShowPost.aspx "The setup utility is a 16-bit app (as you have guessed), and it may gag if the path to its home folder is too long" I simply moved the i

[PyMOL] surface coloring fails with gradient loaded

2006-12-15 Thread Martin Höfling
Hi there, i am trying to render fieldlines and sf potential together in a movie. The movie setup is like this: import os set gradient_spacing=5 load ProtOut.pdb,prot load trajshort.xtc,prot mset 1 -7 show surface set surface_solvent=1 for a in range(1,7): cmd.mdo(a,"delete flines;delete dxmap;de

Re: [PyMOL] surface coloring fails with gradient loaded

2006-12-15 Thread DeLano Scientific
Martin, Just FYI, the gradient display in PyMOL you and I have been working on is still too immature to be considered supportable or supported. Indeed, prior to your post, you were one of the few PyMOL users even aware of it. For everyone else, I suppose I should announce that one of the many ne

Re: [PyMOL] Why does the sculpting feature not work?

2006-12-15 Thread DeLano Scientific
Matt, Three points: (1) PyMOL's sculpting feature isn't a forcefield, so it is best to clean up any pose you" sculpt" with a molecular mechanics forcefield minimization afterwards (using external software, such as the Swiss PDB viewer). (2) Unless bonding information is provided in the file, PyM

[PyMOL] A suggestion on molecule selection

2006-12-15 Thread S. Frank Yan
Hi, When two SDF files, each of which contains multiple entries, are loaded, it seems PyMOL can only display the same frames from the two objects. It goes like frame 1 in obj 1 and frame 1 in obj 2, and cannot do like frame 1 in obj 1 and frame 3 in obj 2. I was wondering if there is a way to

Re: [PyMOL] A suggestion on molecule selection

2006-12-15 Thread DeLano Scientific
Frank, set state, state-number, object-name set state, obj1, 1 set state, obj2, 3 You can also use the freeze and thaw options in the object's action menu to freeze an object into the current state independent of the global state. Cheers, Warren From: pymol-u