Re: [Jmol-users] NMR predictions

[Pierluigi Quagliotto]

Bob,

many thanks for your information about the EPFL server failure.

Regards,

Pierluigi Quagliotto

At 22.48 05/04/2014, you wrote:
This indicates a server failure. The direct test 
of that site is 
http://chemapps.stolaf.edu/jmol/jsmol/testEPFL.htmhttp://chemapps.stolaf.edu/jmol/jsmol/testEPFL.htm

Bob





On Sat, Apr 5, 2014 at 12:36 PM, Pierluigi 
Quagliotto 
mailto:pierluigi.quaglio...@unito.itpierluigi.quaglio...@unito.it wrote:
The same happened to me on iPad first and after on PC and Mac.

Best regards,

Pierluigi Quagliotto


Inviato da iPad

Il giorno 05/apr/2014, alle ore 18:16, Pshemak 
Maslak mailto:n...@psu.edun...@psu.edu ha scritto:

 
  
 http://chemapps.stolaf.edu/jmol/jsmol/jsv_jme.htmhttp://chemapps.stolaf.edu/jmol/jsmol/jsv_jme.htm
  http://chemapps.stolaf.edu/jmol/jsmol/jsv_predict2.htm
 
  do not work with the newst Jmol version. .  Error message:
 
  JSV.exception.JSVException: Error reading data:
  java.lang.NullPointerException
 
  Is it Jmol or any of the other servers?
 
  BTW: does the spectra-simulation algorithm takes into account
  diastereoscopic protons?
 
 
  PM
 
 
 
  
 --
  ___
  Jmol-users mailing list
  mailto:Jmol-users@lists.sourceforge.netJmol-users@lists.sourceforge.net
  https://lists.sourceforge.net/lists/listinfo/jmol-users
 

--
___
Jmol-users mailing list
mailto:Jmol-users@lists.sourceforge.netJmol-users@lists.sourceforge.net
https://lists.sourceforge.net/lists/listinfo/jmol-users




--
Robert M. Hanson
Larson-Anderson Professor of Chemistry
St. Olaf College
Northfield, MN
http://www.stolaf.edu/people/hansonrhttp://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

--
___
Jmol-users mailing list
Jmol-users@lists.sourceforge.net
https://lists.sourceforge.net/lists/listinfo/jmol-users

Dr. Pierluigi Quagliotto - Ph.D. in Chemical Sciences
Faculty Researcher
Università degli Studi di Torino
Dipartimento di Chimica
via Pietro Giuria 7, 10125-TORINO - Italy
Tel. 0039-011-6707593
Fax  0039-011-6707591
First Personal Fax: 0039-011-2367593
Second Fax 0039-02-700448783
E-Mail: pierluigi.quaglio...@unito.it
http://www.chimgenorg.unito.it 


--
___
Jmol-users mailing list
Jmol-users@lists.sourceforge.net
https://lists.sourceforge.net/lists/listinfo/jmol-users

Re: [Jmol-users] iPad Script Question

[Robert Hanson]

looks great to me


On Sat, Apr 5, 2014 at 11:41 PM, Otis Rothenberger osrot...@chemagic.comwrote:

 Bob,

 I'm trying to circumvent the lack of a modifier key (ALT) on an iPad when
 switching between drag translation and rotation of individual multiple
 models.

 On an iPad and laptop, these two scripts do exactly what I want:

 1) CLICK/DRAG TRANSLATES:

 set picking off; set picking ON; set atomPicking true; set picking
 dragmolecule;

 2) CLICK/DRAG ROTATES:

 set picking off; set picking ON; set atomPicking true;set picking
 dragmolecule;set allowRotateSelected TRUE;bind drag _rotateselected;

 Number 1 does not worry me.

 In the case of number 2, I'm concerned that the script is not working
 according to your intentions - i.e. it might change in the future.
 Specifically, every component in script 2 is required to make this work on
 an iPad. I should mention that it's possible that set picking off; set
 picking ON; is not required. I do that as a matter of habit because it
 seems to avoid problems. Every other script command is required: set
 atomPicking true;set picking dragmolecule;set allowRotateSelected TRUE;bind
 drag _rotateselected

 As an aside, I want to mention again that the performance of the JSmol
 model kit on an iPad Air Safari is remarkable. I had pretty much given up
 hope on this several months ago. Android Chrome isn't too shabby either.

 Otis

 --
 Otis Rothenberger
 o...@chemagic.com
 http://chemagic.com








 --
 ___
 Jmol-users mailing list
 Jmol-users@lists.sourceforge.net
 https://lists.sourceforge.net/lists/listinfo/jmol-users




-- 
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
--
Put Bad Developers to Shame
Dominate Development with Jenkins Continuous Integration
Continuously Automate Build, Test  Deployment 
Start a new project now. Try Jenkins in the cloud.
http://p.sf.net/sfu/13600_Cloudbees_APR___
Jmol-users mailing list
Jmol-users@lists.sourceforge.net
https://lists.sourceforge.net/lists/listinfo/jmol-users