google-code-export / cing

Automatically exported from code.google.com/p/cing
0 stars 0 forks source link

Test with 13 entries and berlin example. #99

Closed GoogleCodeExporter closed 9 years ago

GoogleCodeExporter commented 9 years ago
The berlin example needs to run at the end of the month.

Tim needs to provide it first though. Current version isn't final one we were 
using on our code 
jamming session yesterday.

Original issue reported on code.google.com by jurge...@gmail.com on 3 Oct 2008 at 10:13

GoogleCodeExporter commented 9 years ago
Ok, Alan just debugged the test_ccpn.py routine again.
Tested fine with 1brv.

Just waiting for Tim's final file for Berlin then.

Original comment by jurge...@gmail.com on 3 Oct 2008 at 1:06

GoogleCodeExporter commented 9 years ago
Can you submit an additional file for quick tests on our end. 

With one model for the output ensemble and output data (or input were no output 
available) from ARIA such 
as:
chemical shifts, 
peaks, 
RDC, 
dihedrals, 
distances etc.

This would hopefully be below 1 Mb compressed.

If Alan can get that into CING first, that would be great.

Then we can work on the file you already have; All models for both ensembles 
and the in and output restraints 
from ARIA .

Alan, can you pick this up now? 

Original comment by jurge...@gmail.com on 8 Oct 2008 at 6:44

GoogleCodeExporter commented 9 years ago
Please take a look at:
http://nmr.cmbi.ru.nl/~jd/tmp/cing/SRYBDNA.cing

It shows several remaining issues of course.

In the log I get the below errors still too.

Geerten can you sync again and try to fix some of these problems or should I 
postpone my work on the 
server?

I will have my small code changes committed in a few...

Original comment by jurge...@gmail.com on 9 Oct 2008 at 9:09

Attachments:

GoogleCodeExporter commented 9 years ago
Closing for no specific outstanding tasks/bugs reported.

Original comment by jurge...@gmail.com on 16 Oct 2008 at 8:46