Bob, Thanks, I think the solution to our ion display issues can be resolved with the information you sent. On your one question (end of this email), I expected the Jmol default to be reported as the atom charge defaults - not the surface charge defaults. This is not a big issue, particularly in light of your subsequent suggestions.
A question that perhaps I should post in another chain, but I'll list it quickly here: Our Spartan files always load with the X axis perpendicular to the screen. The coordinate rendering correlates exactly to the Spartan file coordinates, but unlike molfiles Jmol loads Spatan files with the Z axis in the plane of the screen. Is this a bug in the reader? Otis Otis Rothenberger chemagic.com > > so you have two ranges -- the actual data (shown first) and the range > you have designated (or Jmol has chosen by default) for the color > range from one end to the other of the color scheme. Is it reporting > something different than you expect? > ------------------------------------------------------------------------------ Start uncovering the many advantages of virtual appliances and start using them to simplify application deployment and accelerate your shift to cloud computing. http://p.sf.net/sfu/novell-sfdev2dev _______________________________________________ Jmol-users mailing list Jmol-users@lists.sourceforge.net https://lists.sourceforge.net/lists/listinfo/jmol-users
