https://cyana.org/w/index.php?action=history&feed=atom&title=CYANA_Commands%3A_peaks_createCYANA Commands: peaks create - Revision history2026-04-20T04:01:22ZRevision history for this page on the wikiMediaWiki 1.45.1https://cyana.org/w/index.php?title=CYANA_Commands:_peaks_create&diff=4608&oldid=prevAdmin: 1 revision2009-01-28T23:35:42Z<p>1 revision</p>
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== Parameters ==<br />
<br />
; distance=''real'': (default: 4.0)<br />
; structures=''integer'': (default: 1)<br />
; additional <br />
; c13|n15 <br />
<br />
== Description ==<br />
<br />
Deletes current peak lists and creates expected peaks using the<br />
structures from the selected structure memories. Peaks are created if<br />
the distance between two assigned proton (or pseudo atom) chemical<br />
shifts is less than d in at least n of the selected structures. To<br />
calculate distances where pseudo atoms are involved, a r-6 weighted<br />
average distance is determined between all protons that are represented<br />
by the pseudo atom. With the option additional, the current peaks<br />
are not deleted and the expected peaks are only added if they are<br />
not already present. Per default, a 2D peak list is created, but with<br />
the options c13 or n15, a 3D 13C- or 15N-correlated NOESY peak list<br />
is simulated.</div>Admin