On Tue, Jan 07, 2014, Timothy J Giese wrote:
>
> Sure - OK. Well, let me just finish this off.
>
> The issue is in antechamber/pdb.c function rpdb
> which assumes that the residue name is left-justified.
Oooh...bad,bad,bad. Thanks for pointing this out...it needs to be fixed.
For some reason, the PDB right-justifies most residue names (like A, G, etc.)
....dave
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Received on Tue Jan 07 2014 - 13:00:03 PST
