Unfortunatley, it seems that some genius at the 'folding at home' project
decided to create a new file format and give it the '.xyz' extension.

The CVS HEAD version of Jmol support this becaue Nico did the work to
implement it.


Miguel

> what format is p2003.xyz? Not XYZ? It has numbers down the left and bonds
> on the right?
>
> 2564  p2003_ab1-42_4mer_opls-dummy
> 1     N       59.758348       96.822567       129.784012      2       509     
> 511     512
> 2     H1      58.801394       96.799278       130.106173      1
> 3     CG2     65.115614       93.481274       125.277843      4       5       
> 6       7
>
> My version of jmolApplet doesn't read this at all, and Chime chokes as
> well.
>
> Bob Hanson
>
>
> SourceForge.net wrote:
>> Bugs item #1192487, was opened at 2005-04-29 17:32
>> Message generated for change (Tracker Item Submitted) made by Item
>> Submitter
>> You can respond by visiting:
>> https://sourceforge.net/tracker/?func=detail&atid=379133&aid=1192487&group_id=23629
>>
>> Category: None
>> Group: None
>> Status: Open
>> Resolution: None
>> Priority: 5
>> Submitted By: Nicolas (nicove)
>> Assigned to: Nobody/Anonymous (nobody)
>> Summary: NullPointerException in Monomer.scanForOffsets
>>
>> Initial Comment:
>> I already posted the problem in the Jmol developers list.
>> I don't know what to do for this problem.
>>
>> The file causing problem is in Jmol-web:
>> fah/projects/p2003.xyz.gz
>>
>> FileManager.openFile(../fah/projects/p2003.xyz.gz)
>> SmarterJmolAdapter:The Resolver thinks:FoldingXyz
>> openFile(../fah/projects/p2003.xyz.gz) 2804 ms
>> Exception in thread "Thread-14"
>> java.lang.NullPointerException
>>      at org.jmol.viewer.Monomer.scanForOffsets
>> (Monomer.java:81)
>>      at
>> org.jmol.viewer.AminoMonomer.validateAndAllocate
>> (AminoMonomer.java:46)
>>      at
>> org.jmol.viewer.Frame.distinguishAndPropogateGroup
>> (Frame.java:434)
>>      at org.jmol.viewer.Frame.finalizeGroupBuild
>> (Frame.java:374)
>>      at org.jmol.viewer.Frame.<init>
>> (Frame.java:192)
>>      at org.jmol.viewer.ModelManager.setClientFile
>> (ModelManager.java:73)
>>      at org.jmol.viewer.Viewer.openClientFile
>> (Viewer.java:1026)
>>      at org.jmol.viewer.Viewer.getOpenFileError1
>> (Viewer.java:999)
>>      at org.jmol.viewer.Viewer.getOpenFileError
>> (Viewer.java:984)
>>      at org.jmol.viewer.Eval.load(Eval.java:1651)
>>      at
>> org.jmol.viewer.Eval.instructionDispatchLoop
>> (Eval.java:351)
>>      at org.jmol.viewer.Eval.run(Eval.java:291)
>>      at java.lang.Thread.run(Unknown Source)
>>
>>
>> ----------------------------------------------------------------------
>>
>> You can respond by visiting:
>> https://sourceforge.net/tracker/?func=detail&atid=379133&aid=1192487&group_id=23629
>>
>>
>> -------------------------------------------------------
>> SF.Net email is sponsored by: Tell us your software development plans!
>> Take this survey and enter to win a one-year sub to SourceForge.net
>> Plus IDC's 2005 look-ahead and a copy of this survey
>> Click here to start!  http://www.idcswdc.com/cgi-bin/survey?id=105hix
>> _______________________________________________
>> Jmol-developers mailing list
>> [email protected]
>> https://lists.sourceforge.net/lists/listinfo/jmol-developers
>
> --
>
> Robert M. Hanson, [EMAIL PROTECTED], 507-646-3107
> Professor of Chemistry, St. Olaf College
> 1520 St. Olaf Ave., Northfield, MN 55057
> mailto:[EMAIL PROTECTED]
> http://www.stolaf.edu/people/hansonr
>
> "Imagination is more important than knowledge."  - Albert Einstein
>
>
>
>
> -------------------------------------------------------
> SF.Net email is sponsored by: Tell us your software development plans!
> Take this survey and enter to win a one-year sub to SourceForge.net
> Plus IDC's 2005 look-ahead and a copy of this survey
> Click here to start!  http://www.idcswdc.com/cgi-bin/survey?id=105hix
> _______________________________________________
> Jmol-developers mailing list
> [email protected]
> https://lists.sourceforge.net/lists/listinfo/jmol-developers
>
>


--------------------------------------------------
Michael T. Howard              [EMAIL PROTECTED]
23 Algonquin Avenue            tele 978-474-4559
Andover,  MA 01810-5527        cell 978-886-3697
USA                            fax  978-662-3126
--------------------------------------------------


-------------------------------------------------------
This SF.Net email is sponsored by: NEC IT Guy Games.
Get your fingers limbered up and give it your best shot. 4 great events, 4
opportunities to win big! Highest score wins.NEC IT Guy Games. Play to
win an NEC 61 plasma display. Visit http://www.necitguy.com/?r 
_______________________________________________
Jmol-developers mailing list
[email protected]
https://lists.sourceforge.net/lists/listinfo/jmol-developers

Reply via email to