there.
Thanks.
*
Jeff Hansen
Department of Chemistry
DePauw University
Greencastle, IN 46135
[EMAIL PROTECTED]
*
-
Using Tomcat but need to do more? Need to support web services
. Be sure to try on a PC as well
using
Firefox.
Bob
Jeff Hansen wrote:
My university is currently trying Moodle as an alternative to
Blackboard for a Course Management System. One of the things I like
about Moodle is that it supports Jmol. However, we have had some
problems so far. I have
it doesn't need my login while you weren't
logged in when you tried it.
*
Jeff Hansen
Department of Chemistry
DePauw University
Greencastle, IN 46135
[EMAIL PROTECTED
Thanks for the response Angel.
On Feb 18, 2007, at 11:51 PM, jmol-users-
[EMAIL PROTECTED] wrote:
Date: Fri, 16 Feb 2007 19:44:44 +0100
From: Angel Herraez [EMAIL PROTECTED]
Subject: Re: [Jmol-users] Moodle and Jmol again
To: jmol-users@lists.sourceforge.net
Message-ID: [EMAIL PROTECTED]
Any help you can provide would be appreciated.
Thanks.
Jeff
*
Jeff Hansen
Department of Chemistry
DePauw University
Greencastle, IN 46135
[EMAIL PROTECTED
are at:
http://people.depauw.edu/jhansen/Presentations/
*
Jeff Hansen
Department of Chemistry
DePauw University
Greencastle, IN 46135
[EMAIL PROTECTED]
*
-
This SF.net
can give.
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle, IN 46135
[EMAIL PROTECTED
.
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle, IN 46135
[EMAIL PROTECTED]
***
On Aug 20, 2008, at 3:43 PM, [EMAIL PROTECTED]
wrote:
Message: 4
Date: Wed, 20 Aug 2008 14:42:00 -0500
From: Robert
it.
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle, IN 46135
[EMAIL PROTECTED]
***
-
This SF.Net
input type=button onclick=appletReady() value=load
/form
/body
/html
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle, IN 46135
[EMAIL PROTECTED
(atomSetArray[0].info);
}
/script
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle, IN 46135
[EMAIL PROTECTED]
***
On Aug 23, 2008, at 11:47 AM
(my favorite), and jmolGetPropertyAsArray() or
jmolGetPropertyAsString()
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle, IN 46135
[EMAIL PROTECTED
, but I'm
having trouble figuring out how to do that.
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle, IN 46135
[EMAIL PROTECTED]
***
On Aug 26, 2008
Thanks Paul. That is very helpful. I was able to use it to display
the data in the array in a text area on the web page. Should prove
useful for figuring out how to mine the data.
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw
'/textarea/p
/form
/div
The page is at http://web.mac.com/jhansen4/Jmol/NewJmolDiv.html if
that will help.
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle, IN 46135
[EMAIL PROTECTED
div instead.
Jeff
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle, IN 46135
[EMAIL PROTECTED]
***
On Aug 27, 2008, at 11:19 AM, Dean Johnston wrote
.
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle, IN 46135
[EMAIL PROTECTED]
***
On Aug 27, 2008, at 11:57 AM, Robert Hanson wrote:
Right -- name attribute
constructor to change
jmol parameters and such. Obviously there are other ways to do that,
but this just seems an attractive way to me for some reason.
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave
Sorry I wasn't clear about this, but the applet corresponding to
result1 is loaded when the page loads. I'll try jmolScriptWait to see
if that does anything for the result2.
f
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw
Thanks. New it had to be something simple like that. For some reason
I needed the \ earlier and it was still there.
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle, IN 46135
[EMAIL
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle, IN 46135
[EMAIL PROTECTED]
***
On Aug 28, 2008, at 10:47 PM, Robert Hanson wrote:
Jeff, why don't you come over to St. Olaf
today. Changes come too fast for me to keep up
with, which is a good thing.
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle, IN 46135
[EMAIL PROTECTED
node = document.createTextNode(text);
_jmolText.appendChild(node);
}
and I have more than one Jmol applet on the page, how do I select
which applet I'm getting the info from?
***
Jeff Hansen
Department of Chemistry
)')
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle, IN 46135
[EMAIL PROTECTED]
***
On Aug 30, 2008, at 11:45 PM, Robert Hanson wrote:
getProperty can be a very inefficient function
I don't know about from the console, but I've used it successfully in
a web page on Safari.
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle, IN 46135
[EMAIL PROTECTED
in Jmol? What I'm looking to see is a file loaded that
has multiple models so I can see each conformer.
Thanks for any help you can provide.
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle
://www.chemtube3d.com
Tel: +44 (0)151-794-3506 (3500 secretary)
Message: 5
Date: Thu, 2 Oct 2008 16:13:42 -0400
From: Jeff Hansen [EMAIL PROTECTED]
Subject: [Jmol-users] problem reading spardir file
To: jmol-users@lists.sourceforge.net
Message-ID: [EMAIL PROTECTED]
Content-Type: text/plain; charset
attempt to open any other file type. The Save File
button allowed me to save a file as a pdb which I could then open.
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle, IN 46135
[EMAIL PROTECTED
, for example, that loads with
multiple models just fine. pdb files load ok too.
Doing this with 11.6 which I just downloaded tonight.
So what is going on here?
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave
for
sure is that it didn't work with out the eval(). Probably because of
the this.loadString syntax. Thanks for the suggestion. Much cleaner.
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle
Never mind about this. I found my problem.
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle, IN 46135
[EMAIL PROTECTED]
***
On Oct 16, 2008, at 10
How can I use Jmol to determine a file's type and assign it to a
variable?
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle, IN 46135
[EMAIL PROTECTED
energy for
each model in the file. My code says which Jmol applet to get it
from, but how do I tell it which model of that file to get the energy
of?
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave
/jmol/
Models/n-butane.xyz
So I have two questions. First, how to get the heat of formation
number out. Second, how to tell the applet which model to get the
energy of.
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
One more thing...
Could I do something like a Jmol script that somehow pulls out the
heats of formation, puts them into an array, then returns that array
or is this something that I can do in Javascript?
***
Jeff Hansen
Department of Chemistry
.
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle, IN 46135
[EMAIL PROTECTED]
***
On Oct 22, 2008, at 4:40 PM, Robert Hanson wrote:
// var Energy
the backslash. Much easier. I'll remember both of those ideas in
the future. Working great now.
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle, IN 46135
[EMAIL PROTECTED
. The applet height was not
right. For some reason it it was maybe 30 or 40 pixels high instead
of filling the table cell.
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle, IN 46135
[EMAIL
of attention to what comes out of Cupertino.
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle, IN 46135
jhan...@depauw.edu
***
On Mar 3, 2009, at 7
not everyone is using Flash, certainly
not exclusively, and plenty of people find Java to be sufficiently
safe and not outmoded.
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle, IN 46135
jhan
, divInc is an id for the particular jmol applet (out of more
than one on the page)
Perhaps you can adapt this for your purposes. Let me know if you have
any questions about it.
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
this on a
PowerBook G4 running OS X 10.5.6 and Spartan 4 beta.
Jeff
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle, IN 46135
jhan...@depauw.edu
***
On Apr 17
I should really learn to read. Just made sense to me that 1,2-
dichloroethane would be a structure for which you would want to see a
Fischer Projection.
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave
whatever is causing the problem.
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle, IN 46135
jhan...@depauw.edu
***
On Apr 23, 2009, at 6:12 PM
containing the structure is loaded into it. Might that be
helpful?
http://web.me.com/jhansen4/iWeb/Jmol/NewJmolDiv.html
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle, IN 46135
jhan
how I might get around this would
be appreciated.
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle, IN 46135
jhan...@depauw.edu
will be required is maybe a rewrite of jmol.js
that uses some DOM based alternative to document.write. Sounds like a
challenge. Should be a good learning experience.
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave
would prefer to use jmol.js but
if necessary can do without it.
Jeff
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle, IN 46135
jhan...@depauw.edu
errors.
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle, IN 46135
jhan...@depauw.edu
***
On May 6, 2009, at 9:36 PM, Angel Herráez wrote:
OK, I
of your revised Jmol.js and begin using that.
Thanks!
Jeff
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle, IN 46135
jhan...@depauw.edu
***
On May
not work there as its implementation of SVG is poor to
non-existent. I don't see a way around that and frankly standards are
there for a reason so as long as my code is standards compliant I'll
be ok with that.
***
Jeff Hansen
Department
not sure why, but since it seems to be necessary I did it.
Jeff
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle, IN 46135
jhan...@depauw.edu
***
On May
affect html pages.
I can't currently test IE8. My understanding is that the svg would
require a plug-in from adobe. Not sure about xhtml.
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle, IN 46135
as a problem?
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle, IN 46135
jhan...@depauw.edu
***
On May 7, 2009, at 12:01 AM, Robert Hanson wrote
.
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle, IN 46135
jhan...@depauw.edu
***
On May 7, 2009, at 8:59 AM, Jonathan Gutow wrote:
I believe this is simply due
Yes. It does the same thing on your page.
I think you are right that it is not likely to work with MSIE.
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle, IN 46135
jhan...@depauw.edu
I don't think that is it. I don't see a checked or selected anywhere
in relation to the offending function.
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle, IN 46135
jhan...@depauw.edu
)
I still get the same error.
The following
http://simonwillison.net/2003/Jun/15/javascriptWithXML/
has a discussion of the issue and a general solution although, as I
said above, it doesn't seem to be working for me.
***
Jeff Hansen
Department
I tried this version of Jmol.js. First I renamed it to Jmol2.js just
to make sure it loaded the right one. I'm still getting the same
error. I think it is from the document.createElement
***
Jeff Hansen
Department of Chemistry and Biochemistry
))
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle, IN 46135
jhan...@depauw.edu
***
On May 7, 2009, at 12:48 PM, Robert Hanson wrote:
Jeff, now if you are going
to do this is to learn
something new. My guess is that in the end I'll develop parallel
solutions, one with Divgraph and one with svg. I might even do a
third using the canvas object - haven't decided yet.
Thanks for the help.
***
Jeff Hansen
Yes. From a website. Same error with your page.
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle, IN 46135
jhan...@depauw.edu
***
On May 7, 2009
. Is this the intended
behavior?
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle, IN 46135
jhan...@depauw.edu
***
On May 8, 2009, at 12:52 AM, Robert Hanson
of the summer too.
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle, IN 46135
jhan...@depauw.edu
***
On May 8, 2009, at 8:19 AM, Robert Hanson wrote:
Jeff
overkill since its just for looks. I've thought about trying to
do it somehow with bezier curves. Any suggestions?
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle, IN 46135
jhan...@depauw.edu
this and/or how to fix it I would appreciate
hearing it.
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle, IN 46135
jhan...@depauw.edu
someone point me in the direction of how to make changes in
the applet trigger an event?
http://web.me.com/jhansen4/iWeb/Jmol/JmolPlusSVG.xhtml
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle
Great. Will do. Thanks.
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle, IN 46135
jhan...@depauw.edu
***
On May 19, 2009, at 4:12 AM, Angel
the corresponding point in the graph. Still need
axes and some other niceties but I'm pretty sure the code to do that
is out there somewhere so I'll put that in next week.
http://web.me.com/jhansen4/iWeb/Jmol/JmolPlusSVG.xhtml
***
Jeff Hansen
Department
not.
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle, IN 46135
jhan...@depauw.edu
an onclick=circle_click(evt) within the tag for the circle
element in the svg.
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle, IN 46135
jhan...@depauw.edu
any help anyone could
provide to take this further.
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle, IN 46135
jhan...@depauw.edu
.
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle, IN 46135
jhan...@depauw.edu
***
On Jun 4, 2009, at 1:22 PM, Angel Herráez wrote:
Hello nmckenna
As far
be
a better solution than a new window. Hope this helps.
Jeff
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle, IN 46135
jhan...@depauw.edu
It may be that there is a problem, but I don't see it on my computer
which is a MacBook Pro running OS X 10.5.8 and using Safari 4.0.3.
The animation runs smoothly throughout.
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw
be desirable or is this something better left not done?
Jeff
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle, IN 46135
jhan...@depauw.edu
a single value of 0.06260959.
Any ideas what I'm doing wrong here?
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle, IN 46135
jhan...@depauw.edu
Is there somewhere I can see what file types Jmol can read and what
the format of each of those file types is?
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle, IN 46135
jhan...@depauw.edu
- just a slightly different color or lighter shade - would
lead people to think it was a menu, which it is.
Jeff
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle, IN 46135
jhan...@depauw.edu
but then it wouldn't be so obvious that it is a menu. Like
I said, I haven't seen David's suggestion. It might work fine. I do
think having it in the top left is more likely to trigger one to think
it is a menu.
***
Jeff Hansen
Department
there. Some mouse-over prompt as Bob
suggested would be good in addition to that.
Jeff
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle, IN 46135
jhan...@depauw.edu
of consistency and over time things
will seem more intuitive.
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle, IN 46135
jhan...@depauw.edu
***
On Oct
On Oct 20, 2009, at 12:08 PM, Robert Hanson wrote:
And about the Mac interface, there's lots of help to get started
either with the system help or with online tutorials. Once you get
started I think you'll find lots of consistency and over time things
will seem more intuitive.
The
we want to adjust? Kind of a built in
slider.
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle, IN 46135
jhan...@depauw.edu
***
On Nov 18, 2009
I've seen this before too - I believe in .mol files output from Spartan.
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle, IN 46135
jhan...@depauw.edu
. Starting a new SourceForge project would
not preclude continuing to use it in Jmol.
Jeff
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle, IN 46135
jhan...@depauw.edu
retrieved.
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle, IN 46135
jhan...@depauw.edu
***
On Dec 16, 2009, at 5:35 PM, rgb wrote:
It detracts from
Very nice!
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle, IN 46135
jhan...@depauw.edu
***
On Jan 2, 2010, at 4:35 PM, Jonathan Gutow wrote
make it that much more
useful.
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle, IN 46135
jhan...@depauw.edu
***
On Jan 9, 2010, at 4:57 PM
. The molecule was strange in that it was completely flat
with several atoms overlapping. I don't know if that is how the structure
should be, but it looked very odd.
Hope this helps.
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602
Forgot to mention this was with Safari 4.0.4. Pretty much the same behavior in
Firefox 3.5.6.
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle, IN 46135
jhan...@depauw.edu
How about selecting aromatic rings or different functional groups?
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle, IN 46135
jhan...@depauw.edu
If the applet were within a div of defined size would the size of the div stay
the same and thereby keep the applet the same size? Don't know but thought
maybe this could be a solution?
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw
believe would all be done outside
of Jmol using javascript (to rewrite the trajectory file) then tell Jmol to
reload the trajectory file. Is that what you need?
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College
All three of the links on that page worked for me on Mac OS X 10.6.3 and Safari
4.0.4. However, when I tried to drag a pdb file from a Finder window, I got a
FileNotFoundException.
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw
the other? By
simple I mean with mouse actions. I know it could be done via the console.
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle, IN 46135
jhan...@depauw.edu
All worked fine for me, including drag and drop of multiple files from multiple
folders in Finder. On Firefox 3.6 and OS X 10.6.3.
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle, IN 46135
How about hovering over the bond instead of atoms, or at least a single click
on the bond instead of having to click two atoms.
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle, IN 46135
jhan
and two-finger scrolling?
Even outside of using a MacBook Pro, I'm sure not everyone uses a scroll wheel.
Jeff
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle, IN 46135
jhan...@depauw.edu
Still does not work with a trackpad.
***
Jeff Hansen
Department of Chemistry and Biochemistry
DePauw University
602 S. College Ave.
Greencastle, IN 46135
jhan...@depauw.edu
***
On Apr 15, 2010, at 8:19 AM
1 - 100 of 165 matches
Mail list logo