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It is unique in a sense that it is closest to Bob Diamond's original
work (197?), and also it uses LS=SUM(rho_obs-rho_calc)**2, where
rho_calc is resolution truncated analytical density function
originally developed by Michael Chapman and published I guess in
1995.<br>
<br>
More details:<br>
<a class="moz-txt-link-freetext" href="http://phenix-online.org/presentations/latest/pavel_refinement_general.pdf">http://phenix-online.org/presentations/latest/pavel_refinement_general.pdf</a><br>
pages 37-40.<br>
<br>
Pavel<br>
<br>
<br>
<br>
<div class="moz-cite-prefix">On 7/28/14, 12:17 PM, Nathaniel Echols
wrote:<br>
</div>
<blockquote
cite="mid:CALeAa1MAQpk4y2uWpYYcqN-f-HSPxke7YN3iQMS=ET+e7RB7YA@mail.gmail.com"
type="cite">
<div dir="ltr">On Mon, Jul 28, 2014 at 12:12 PM, Tim Gruene <span
dir="ltr"><<a moz-do-not-send="true"
href="mailto:tg@shelx.uni-ac.gwdg.de" target="_blank">tg@shelx.uni-ac.gwdg.de</a>></span>
wrote:<br>
<div class="gmail_extra">
<div class="gmail_quote">
<blockquote class="gmail_quote" style="margin:0 0 0
.8ex;border-left:1px #ccc solid;padding-left:1ex">- -
Michael Chapman's RSRef<br>
(<a moz-do-not-send="true"
href="http://www.sb.fsu.edu/%7Ersref/Distribution/software_distribution.htm"
target="_blank">http://www.sb.fsu.edu/~rsref/Distribution/software_distribution.htm</a>)<br>
</blockquote>
<div><br>
</div>
<div>Argh, forgot to mention this! That's probably the
closest analogue, although I don't think it does local
refinement (i.e. sidechain fitting), does it?</div>
<div><br>
</div>
<div>-Nat </div>
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</pre>
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