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VuisterLab / cing

Automated Validation of NMR Structures
http://nmr.le.ac.uk
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Adding more Queeny to RDB #307

Closed GoogleCodeExporter closed 9 years ago

GoogleCodeExporter commented 9 years ago 
By Wim's request:

Queeny info per atom to RDB.
1 after topology addition
2 after DR addition
2-1 is the experimental contribution.

Original issue reported on code.google.com by jurge...@gmail.com on 19 Sep 2011 at 1:08

GoogleCodeExporter commented 9 years ago 
NB according to Geerten the residue summation of the atom values is off.

Original comment by jurge...@gmail.com on 20 Sep 2011 at 7:51

GoogleCodeExporter commented 9 years ago 
Added to r1075 but leaving issue open to find out more about the residue bug.

Original comment by jurge...@gmail.com on 20 Sep 2011 at 12:46

GoogleCodeExporter commented 9 years ago 
Please reopen when reporting the mentioned bug.

Original comment by jurge...@gmail.com on 27 Feb 2012 at 9:12