Sorry this isn't supported right now. I'm currently working on the restraints system, so there is hope that it will work eventually.<div>Ralf<br><br><div class="gmail_quote">On Thu, Mar 15, 2012 at 8:20 AM, Maxime Cuypers <span dir="ltr"><<a href="mailto:cuypers@ill.fr">cuypers@ill.fr</a>></span> wrote:<br>
<blockquote class="gmail_quote" style="margin:0 0 0 .8ex;border-left:1px #ccc solid;padding-left:1ex">hello,<br><br>What is the best way to selectively remove bond length restraints on some selected atoms for phenix.refine? <br>
i found the commands for a .param file:<br><br>refinement {<br>� geometry_restraints.remove {<br>
��� angles = None<br>��� dihedrals = None<br>��� chiralities = None<br>��� planarities = None<br>� }<br>}<br><br>but no bond length command in the manual online. <a href="http://www.phenix-online.org/version_docs/dev-283/refinement.htm" target="_blank">http://www.phenix-online.org/version_docs/dev-283/refinement.htm</a><br>
otherwise there is the commands <br><br>refinement {<br>� geometry_restraints.edit {<br>��� bond {<br>��� � action=� *delete change<br>��� � atom_selection_1= (selection1 here)<br>��� � atom_selection_2= (selection2 here)<br>
��� � distance_ideal= None<br>��� }<br>� }<br>}<br><br>is it a good way to deal with the problem ? <br>thanks in advance for your help.<span class="HOEnZb"><font color="#888888"><br><br>Maxime<br><br>
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<br></blockquote></div><br></div>