Spoken by a man whose school fight song is Um Yah Yah...

Happy to do it. I'm putting some stuff together for BCCE, and I might as well 
do all the testing on your latest versions.

Otis


Sent from my iPad

> On Mar 30, 2016, at 12:10 AM, Robert Hanson <hans...@stolaf.edu> wrote:
> 
> Otis, thanks so much for testing this. It has to do with that needed reversal 
> of connection numbers and branches. There was still a bug in the switching 
> code. In the process of fixing that, I discovered a line I dropped from the 
> code that broke Jmol's ability to check stereochemistry in one SMILES string 
> against another. So, as we say in Minnesota: Ya sure, a two-fer. Uff da!
> 
> Download Jmol-14.4.4_2016.03.29-binary.zip (61.3 MB) 
> 
> Jmol.___JmolVersion="14.4.4_2016.03.29"
> 
> code: ru.po updated (Angel Herraez)
> 
> bug fix: SMILES generator still broken in 14.4.4_2016.03.25
> bug fix: smiles1.find("SMILES",smiles2) broken in 14.4.3_2016.03.06  
> 
> new feature: Polyhedra command allows for min and max radius
>   -- polyhedra 2.8 3.0 @3 
> 
> bug fix: unitcell PRIMITIVE for rhombohedral groups not implemented
> bug fix: unitcell("primitive","R")  not implemented
>  
> bug fix: WRITE IMAGE with negative width or height should throw a Jmol 
> ScriptException
> bug fix: draw ... [x y] does not position properly with antialias true
> bug fix: allow AXES TYPE "" or non-recognized to be same as "abc"
> bug fix: AXES TYPE "ab" should also be allowed when offset or center is set
> bug fix: labels should not change size when creating images of 
>          different size than screen when angstromsPerInch != 0.
> bug fix: if...BREAK|CONTINUE in unbracketed context does not properly 
>          place implicit END IF when TRUE clause is on next line
>          AND next statement after that is another IF command:  
>             if (xxxx)
>               break;
>             if (yyyy)
>               zzzz;
>           becomes
>             if (xxxx) {
>               break;
>               if (yyyy) {
>                 zzzz;
>               }
>             }
>           instead of
>             if (xxxx) {
>               break;
>             }
>             if (yyyy) {
>               zzzz;
>             }
>                
> 
> 
> 
>> On Tue, Mar 29, 2016 at 9:01 PM, Robert Hanson <hans...@stolaf.edu> wrote:
>> shoot! Thanks for testing, Otis...
> 
> 
> 
> -- 
> Robert M. Hanson
> Larson-Anderson Professor of Chemistry
> Chair, Department 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
> 
> ------------------------------------------------------------------------------
> Transform Data into Opportunity.
> Accelerate data analysis in your applications with
> Intel Data Analytics Acceleration Library.
> Click to learn more.
> http://pubads.g.doubleclick.net/gampad/clk?id=278785471&iu=/4140
> _______________________________________________
> Jmol-users mailing list
> Jmol-users@lists.sourceforge.net
> https://lists.sourceforge.net/lists/listinfo/jmol-users
------------------------------------------------------------------------------
Transform Data into Opportunity.
Accelerate data analysis in your applications with
Intel Data Analytics Acceleration Library.
Click to learn more.
http://pubads.g.doubleclick.net/gampad/clk?id=278785471&iu=/4140
_______________________________________________
Jmol-users mailing list
Jmol-users@lists.sourceforge.net
https://lists.sourceforge.net/lists/listinfo/jmol-users

Reply via email to