From: mth <mt...@mt...> - 2002-11-16 10:27:06
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I changed the povray code to use the changes I have made to screen scaling calculations. It now uses the molecule center and radius to the outermost atom to define the scaling. There are a couple of scaling factors which are used in the povray code that I don't understand. One looks legitimate (magnitude squared). The other looks like a fudge factor (0.7). Based upon the testing I did, I think they should be removed. The images are larger without these scaling factors. It worked fine on the few molecules which I tried. Nevertheless, I left them in since I don't understand them. Q: Is there anybody who is familiar with this code (or with the math, or with povray) who could explain it to me? Separately, I observed that molecules rendered in povray do not look exactly the same as they do in jmol. The atoms in the background seem to be in slightly different positions. I assume that the difference is that povray does a more accurate job of calculating perspective. Miguel |