Re: [Jmol-users] way to recalculate bonds when atoms are moved?

[Robert H. <ha...@st...>]

sure

connect AUTO




On Tue, Oct 1, 2013 at 7:23 PM, Angel Herráez <ang...@ua...> wrote:

> I am moving some atoms by changing their xyz values
> I would like Jmol to recalculate bonds (autobonding algorithm would be ok)
>
> Is there a way?
>
> I investigated "set autobond" but that only applies before file loading.
>
> So what I'd need is
> 1. load a file (with or without autobonding)
> 2. move some atoms changing their xyz property
> 3. force recalculation of bonds
>
>
>
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-- 
Robert M. Hanson
Larson-Anderson Professor of Chemistry
St. Olaf College
Northfield, MN
http://www.stolaf.edu/people/hansonr


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