Subject: Re: [nmr_sparky] sparky spectrum list assigned residue names split
From: Woonghee Lee
Date: Apr 8, 2019

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Dear David,

If you have multiple numerical characters in the residue name, the first one will be parsed. In your case, I would suggest saving peak lists and using spreadsheet (Excel) or writing a simple python codes.

Best,

Woonghee

On Mon, Apr 8, 2019, 07:12 Schröder, David Christopher dschroeder@... [nmr_sparky] nmr_sparky@yahoogroups.com wrote:
 

Dear all,

 

I am using sparky as a beginner to assign small modified peptides(peptide bonds replaced by triazoles). Therefor

I used our pdb nomenclature for assignments. All my residue names consist of three characters followed by the residues number.

E.g. ALA7 V4n18 L4c22. For the NOESY spectrum list I would like to have it split accordingly: 7 ALA HA; 18 V4n HB etc. However it splits prior the

first number instead of three letters. Is there a possibility to define artificial residue names?

 

Best regards,

David