Subject: R: [nmr_sparky] noe distance restraints
From: Marco Sette
Date: Sep 27, 2012

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Hi Werkawi,

the peak list you generate with lt after integration can be saved in a .list file.
This file can be the input for some program, in python or the language you prefere, to group the peaks as weak (below an assigned value), medium or strong.
Ciao ciao
Marco


Dr.Marco Sette, Ph.D.

Department of Chemical Sciences and Technology
University of Rome, Tor Vergata
via della Ricerca Scientifica, 00133, Rome, Italy
e-mail: sette@...
e-mail: m77it@...
Tel.: +39-0672594424
Fax: +39-0672594328

www.rete29aprile.it

--- Gio 27/9/12, werkawi ariamisak@... ha scritto:

Da: werkawi ariamisak@...
Oggetto: [nmr_sparky] noe distance restraints
A: nmr_sparky@yahoogroups.com
Data: Giovedì 27 settembre 2012, 21:41

Hello Sparky users,

i want to generate distance retraints from the Noe peak volumes i have. sofar i have integrated all the peaks and i tried to classify them into bins (strong , medium, weak noes) but it didnt work.can any one give me more detailed information on how to do this. thanks.

Werkawi