Bob,
Rats! It’s reporting no difference, but there is a difference. This seems to be
OK:
$("#log").html(nci==calc ? "no difference" : "check differences?”);
Calc seems to be OK. The problem is what’s printed on the screen for calc.
Otis
--
Otis Rothenberger
[email protected]
http://chemagic.org
> On Mar 7, 2016, at 6:33 PM, Otis Rothenberger <[email protected]> wrote:
>
> Bob,
>
> I think it may be a timing issue with the function below. When I comment out
> the initial JQuery working… html replacements, the page no longer “locks.” I
> don’t think it was really locking. I think those html replacements somehow
> ran after the subsequent code. Which…
>
> makes absolutely no sense to me! Nevertheless, it seems to fix the problem.
>
> function getInChI(app,url) {
> //$("#inchi2div").html("working...");
> //$("#inchi1div").html("working...");
> //$("#log").html("working...");
> if (!url) { return; }
> nci = Jmol.evaluateVar(jmolApplet0,"show('chemical stdinchi')").trim();
> $("#inchi2div").html(nci + " (from NCI/CADD)");
> calc =
> InChI.fromMolfile(Jmol.evaluateVar(jmolApplet0,"write('MOL')")).trim();
> $("#inchi1div").html(calc + " (calculated in
> JavaScript)");
> $("#log").html(nci==calc ? "no difference" : "check differences?");
> }
>
> Otis
>
> --
> Otis Rothenberger
> [email protected]
> http://chemagic.org
>
>> On Mar 7, 2016, at 4:37 PM, Robert Hanson <[email protected]> wrote:
>>
>> Otis, note that there is a bug there. If you ask for the models in this
>> order:
>>
>> $taxol
>> $morphine
>>
>> inchi.js seems to hang and just never respond. Something to do with the fact
>> that $taxol is pathologically 2D and not 3D. But
>>
>> $taxol
>> $methanol
>>
>> works, until you ask for $morphine. Then it hangs.
>>
>> Go figure!
>>
>>
>> Bob
>>
>>
>>
>>
>
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