jakesylvestre / cing

Automatically exported from code.google.com/p/cing
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Wattos fails in NMR_REDO, because toNmrStarFile fails and no CCPN project was read first #340

Open GoogleCodeExporter opened 8 years ago

GoogleCodeExporter commented 8 years ago
Wattos is skipped NMR_REDO, even though doWattos=True. Why?
Consequences:
-The Wattos HTML for REDO is the same as for NRG-CING.
-There are no Wattos files for REDO and nothing is stored in the RDB.

Original issue reported on code.google.com by WGTouw on 8 Feb 2013 at 9:31

GoogleCodeExporter commented 8 years ago
We get:

DEBUG: Failed to find ccpn attribute project. Happens when no CCPN project was 
read first.

And then in //PluginCode/Wattos#_runWattos we find 

Failed to nmrStar.toNmrStarFile (fine if there wasn't a CCPN project to start 
with)

If there is no NmrStar file, Wattos checks will fail with error code 2304.

How can we make sure Wattos does run?

Original comment by WGTouw on 8 Feb 2013 at 9:59

GoogleCodeExporter commented 8 years ago

Original comment by WGTouw on 8 Feb 2013 at 10:06

GoogleCodeExporter commented 8 years ago
or can we do something with python/cing/Libs/NoeCompleteness.py ?

Original comment by WGTouw on 12 Feb 2013 at 12:13

GoogleCodeExporter commented 8 years ago
Nop, I think that Wattos can only start from NMR-STAR and only from CCPN that 
is created so ...
It's unexpected but was never a function. Modifying Type to Enhancement as it's 
a new feature to enable this request.

Original comment by jurge...@gmail.com on 16 May 2013 at 8:34