Subject: Re: AW: [nmr_sparky] error while converting bruker files
From: Marco Sette
Date: Jun 29, 2018

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Hi David,

not sure there are differences.
Many people, including myself, use a different software to process data. I use NMRpipe rather than Topspin. NMRPipe results cannot be read inside Sparky, unless the bruk2ucsf conversion is done.
So, I think there are no differences in reading directly the 2rr files. The old Sparky manual do not mention possible differences.
Good luck with your project
Best
Marco


Da: dschroeder@... [nmr_sparky] nmr_sparky@yahoogroups.com
A: nmr_sparky@yahoogroups.com
Inviato: Venerdì 29 Giugno 2018 14:29
Oggetto: AW: [nmr_sparky] error while converting bruker files

Hi Marco,
Thanks for your answer. I normally use MestreNova as our Uni offered this
As primary software for NMR. However I have a coorperation with another
workgroup for molecular dynamic calculation. Within this project I was told
to use sparky due to getting good integration results for ROESY/NOESY signals.
So I don’t have that much experience about sparky. I was told to use this script for
COSY TOCSY ROESY HMBC HMQC data files. However you are right I can open directly
The 2rr file with sparky. Is there any difference compared to converting the files first, I mean
There must be one, otherwise it does not make sense that they always did it that way.
Thanks for explaining me,
David
----------------------------------------------
David Christopher Schröder, M. Sc.
Organic and Bioorganic Chemistry
Department of Chemistry
Bielefeld University
Universitätsstraße 25
D-33615 Bielefeld
+49 (0)521 106 2152
dschroeder@...
Von: nmr_sparky@yahoogroups.com nmr_sparky@yahoogroups.com
Gesendet: Freitag, 29. Juni 2018 14:05
An: nmr_sparky@yahoogroups.com
Betreff: Re: [nmr_sparky] error while converting bruker files
As far I know you do not need to convert 2rr files since Sparky is able to read it.
Best
Marco

Da: dschroeder@... [nmr_sparky] nmr_sparky@yahoogroups.com
A:
nmr_sparky@yahoogroups.com
Inviato: Venerdì 29 Giugno 2018 13:55
Oggetto: [nmr_sparky] error while converting bruker files
Dear all,
I have a problem while converting bruker files to spraky file format.
P:DCS OligomereOC3_SchroederDa_0605_DCS56prepHF8C:Program Files (x86)sparky-win32sparkybinbruk2ucsf.exe pdata12rr DCS56prepHF_ROESY.ucsf
bruk2ucsf: Couldnt find parameter BYTORDP in pdata1procs
In the mailing list I found a similar error with the assumption that it is due to a network path. However I copied to my local Desktop but still get the same problem.
C:UsersDavid_SchroederDesktopOC3_SchroederDa_0605_DCS56prepHF8C:Program Files (x86)sparky-win32sparkybinbruk2ucsf.exe pdata12rr DCS56prepHF_ROESY.ucsf
bruk2ucsf: Couldnt find parameter BYTORDP in pdata1procs
In procs I also find
##$BYTORDP= 0
So I have no idea how to solve this issue.
Thank you for your help and best regards
David