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<div dir="auto">Hi,
<div dir="auto">Just insert these lines into the .eff file that you generated (through the gui) and execute the new .eff file. That's the simplest way to do this, I would think.</div>
<div dir="auto">Stay safe.</div>
<div dir="auto">Boaz<br>
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<div dir="auto">Boaz Shaanan, Ph.D.<br>
Department of Life Sciences<br>
Ben Gurion University of the Negev<br>
Beer Sheva<br>
Israel</div>
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<div class="gmail_quote">On Mar 27, 2020 15:42, Valerie Biou <valerie.biou@ibpc.fr> wrote:<br type="attribution">
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<div>Hello
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<div class="">I am trying to impose restraints on my lipid ligand during real space refinement. I found the command</div>
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<div class=""><font face="Courier" class="">refinement.geometry_restraints.edits.scale_restraints {</font></div>
<div class=""><font face="Courier" class=""> atom_selection = "resname LLP"</font></div>
<div class=""><font face="Courier" class=""> scale = 2.5</font></div>
<div class=""><font face="Courier" class=""> apply_to = *bond *angle dihedral chirality</font></div>
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<div class="">I have 2 questions</div>
<div class=""><span class="Apple-tab-span" style="white-space:pre"></span>1) can those lines be called from the GUI and where? if not, how can I insert them in a previous command file?</div>
<div class=""><span class="Apple-tab-span" style="white-space:pre"></span>2) what do the * stand for? is it to activate or cancel the selection of an item?</div>
<div class="">sorry if those questions have been asked before, I can't find the command to browse the bb archive.</div>
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<div class="">All the best,</div>
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<div class="">Valérie </div>
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