On Tue, 19 Jan 2010 14:03:32 -0600, Robert Hanson <hans...@stolaf.edu> wrote: > Is that in the file somewhere? What I have is > > dmin dmax dmean (density min max mean) > > rms > > Now, I DON'T think the "rms" is really "rms" -- I think it's rms deviation, > but I could be wrong about that. What seems to work as a reasonable default > is > > dmean + 2*rms > > But that could be a complete misuse of the numbers. > > OK, Brian -- we want an answer from you, then! How do we do this? :) >
1 sigma = 1 esd = 1 rmsd*rmsd i.e. the rmsd is the square root of the esd so to contour the map at 2.5 sigma: square the rmsd and multiply by 2.5 and plot lines from dmin to dmax at that interval. Rich ------------------------------------------------------------------------------ Throughout its 18-year history, RSA Conference consistently attracts the world's best and brightest in the field, creating opportunities for Conference attendees to learn about information security's most important issues through interactions with peers, luminaries and emerging and established companies. http://p.sf.net/sfu/rsaconf-dev2dev _______________________________________________ Jmol-users mailing list Jmol-users@lists.sourceforge.net https://lists.sourceforge.net/lists/listinfo/jmol-users
