Actually I have an HSQC spectrum for which the NMR structure has already been solved. So, instead of assigning the peaks, I tried using SPARTA(one of the prediction programs available). I want to generate a peak list from the prediction programs output and align the peaks on the spectra I obtained by experiments to know how well the peaks can be predicted and if I can get any information of the amino acids from the spectra. I am a novice in NMR and working in a primarily Crystallography lab so have no one to help me with this. Hoping some replies soon.
I think I am much more clear now.
Regards, Ankit
----- Original Message ---- From: Krzysztof Kazimierczuk krzysztof.kazimierczuk@... To: nmr_sparky@yahoogroups.com Sent: Friday, May 30, 2008 4:22:29 PM Subject: Re: [nmr_sparky] List of peaks to Spectrum
Hi Ankit!
Could you be a little more precise? i dont get what are you going to do... You have the peaklist and want to obtain something like artificial spectrum based on your peaklist? How does your peaklist look like? I have an own-written program which I use for generation of artificial spectra and it uses Sparky peaklist file, but I am not sure whether that is what You are looking for...
Cheers, Krzysztof
----- Original Message ---- From: Ankit techankit@yahoo. com To:
nmr_sparky@yahoogro ups.com Sent: Friday, May 30, 2008 6:05:51 PM Subject: [nmr_sparky] List of peaks to Spectrum
Hello Forum,
I have an HSQC spectrum for which I have predicted the assignments
from the known spectra. Is there a way to get a spectrum out of the
peak list. Is the peak list readable in sparky?