PiRSquared17 / cing

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Bad linking from dihedral angle list to residue #238

Closed GoogleCodeExporter closed 9 years ago

GoogleCodeExporter commented 9 years ago
What steps will reproduce the problem?
1. Look at attached output; the phi restraint is listed purely on the first 
atom:
9    A  186 CYSS    phi C   N   CA  C   
which is CYSS 186 but should have been listed as the next residue 187 HIS.

What algorithm/definitions should we use? Simply use IUPAC's?

Original issue reported on code.google.com by jurge...@gmail.com on 19 Apr 2010 at 10:09

Attachments:

GoogleCodeExporter commented 9 years ago
Related for Talos+ derived

Original comment by jurge...@gmail.com on 19 Apr 2010 at 11:53

Attachments:

GoogleCodeExporter commented 9 years ago
Fixed in r761.

Original comment by jurge...@gmail.com on 19 Apr 2010 at 1:46

GoogleCodeExporter commented 9 years ago

Original comment by jurge...@gmail.com on 19 Apr 2010 at 1:47