Re: [Jmol-users] Minimize Seems to be Broken Jmol 12.0.RC13_dev

[Otis R. <osr...@ch...>]

Bob,

That fixes it.

The dragMinimize feature brings a lot of utility to the model editor - 
invert configuration, create a twisted boat, tidy up a model that UFF 
did not get quite right (The work arounds are gone.), quickly create a 
cisoid conformation for a ring closure, just to name a few.

Otis

On 5/22/2010 10:18 AM, Robert Hanson wrote:
> Otis, that should be fixed now for 
> http://chemapps.stolaf.edu/jmol/docs/examples-11/Jmol-11.zip
>
> On Fri, May 21, 2010 at 8:02 PM, Otis Rothenberger 
> <osr...@ch... <mailto:osr...@ch...>> wrote:
>
>     Bob,
>
>     Earlier today you fixed a problem with Jmol 12.0.RC13_dev.
>     Specifically,
>     minimize seemed to be broken on the initial load. That fix worked.
>
>     There seems to be another problem, however. It's taken me a while to
>     track it down, but after an atom delete, minimize breaks.
>     Interestingly,
>     minimize addHydrogens does not break, however hydrogens are not
>     corrected on this command unless all hydrogens are deleted first.
>
>     Otis
>
>     --
>     Otis Rothenberger
>     chemagic.com <http://chemagic.com>
>
>
>
>
>     ------------------------------------------------------------------------------
>
>     _______________________________________________
>     Jmol-users mailing list
>     Jmo...@li...
>     <mailto:Jmo...@li...>
>     https://lists.sourceforge.net/lists/listinfo/jmol-users
>
>
>
>
> -- 
> Robert M. Hanson
> Professor of Chemistry
> St. Olaf College
> 1520 St. Olaf Ave.
> Northfield, MN 55057
> http://www.stolaf.edu/people/hansonr
> phone: 507-786-3107
>
>
> If nature does not answer first what we want,
> it is better to take what answer we get.
>
> -- Josiah Willard Gibbs, Lecture XXX, Monday, February 5, 1900
>
>
> ------------------------------------------------------------------------------
>
>    
>
>
> _______________________________________________
> Jmol-users mailing list
> Jmo...@li...
> https://lists.sourceforge.net/lists/listinfo/jmol-users
>    

-- 
Otis Rothenberger
chemagic.com