Re: [PyMOL] Electronic density maps

2004-06-22 Thread Konrad Hinsen
On Jun 22, 2004, at 16:52, Warren DeLano wrote: Using crystallographic formats like XPLOR for generic volume visualization is tricky because ultimately the map must be aligned on a grid which passes through the origin. In other words, the grid spacing must Bad news. My map has a

Re: [PyMOL] Electronic density maps

2004-06-22 Thread Michael George Lerner
On Tue, 22 Jun 2004, Konrad Hinsen wrote: Bad news. My map has a grid spacing of 2 angstrom, I need better resolution than that for placing it. So now I am trying chempy.brick. If you're using the CVS version of PyMOL, you might try DX multigrid formatted files. You can find some brief

[PyMOL] Electronic density maps

2004-06-21 Thread Konrad Hinsen
I am trying to visualize electronic densities that I prepare in my own code. This means that I have to write them in XPlor format in order to load them into PyMOL. Is there anywhere a detailed description of that format, preferably with some example files? The best I could find is a summary.

RE: [PyMOL] Electronic density maps

2004-06-21 Thread Warren DeLano
] Electronic density maps I am trying to visualize electronic densities that I prepare in my own code. This means that I have to write them in XPlor format in order to load them into PyMOL. Is there anywhere a detailed description of that format, preferably with some example files? The best I