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Hi Nigel,<br>
<br>
so... what exactly one needs to click to get H (or D) added to
waters? I just spent 10 minutes trying all permutations and still
don't get what Maxime asked for.<br>
<br>
Pavel<br>
<br>
<div class="moz-cite-prefix">On 11/24/14 10:00 AM, Nigel Moriarty
wrote:<br>
</div>
<blockquote
cite="mid:CANkP=2eWU7Hb0jZDbGOrkm711R1uhJRo0kdxY_xS3FGfYq81Mw@mail.gmail.com"
type="cite">
<div dir="ltr">Maxime
<div><br>
</div>
<div>I have attached a screen shot of the neutron refinement
options.</div>
</div>
<div class="gmail_extra"><br clear="all">
<div>
<div class="gmail_signature">
<div dir="ltr">Cheers
<div><br>
</div>
<div>Nigel
<div><br>
</div>
<div>---</div>
<div>Nigel W. Moriarty<br>
Building 64R0246B, Physical Biosciences Division<br>
Lawrence Berkeley National Laboratory<br>
Berkeley, CA 94720-8235<br>
Phone : 510-486-5709� �� Email : <a class="moz-txt-link-abbreviated" href="mailto:NWMoriarty@LBL.gov">NWMoriarty@LBL.gov</a><br>
Fax�� : 510-486-5909� � �� Web� : <a
moz-do-not-send="true" href="http://CCI.LBL.gov"
target="_blank">CCI.LBL.gov</a></div>
</div>
</div>
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<br>
<div class="gmail_quote">On Sat, Nov 22, 2014 at 12:30 PM,
Maxime Cuypers <span dir="ltr"><<a moz-do-not-send="true"
href="mailto:maximecuypers@gmail.com" target="_blank">maximecuypers@gmail.com</a>></span>
wrote:<br>
<blockquote class="gmail_quote" style="margin:0 0 0
.8ex;border-left:1px #ccc solid;padding-left:1ex">
<div dir="ltr">
<div>hello,<br>
<br>
</div>
after not using phenix for a while, i just realised the
new versions do not include the option in ready_set gui to
add H or D atoms to waters in the pdb models (and only to
the waters without altering the rest of the model would be
nice). of course it can be done on the command line but
why has it been removed? it is a very neutron
crystallographer friendly option don t you think? <br
clear="all">
<div>
<div><br>
</div>
<div>cheerios,<span class="HOEnZb"><font color="#888888"><br>
</font></span></div>
<span class="HOEnZb"><font color="#888888">
<div>-- <br>
<div>
<div dir="ltr">
<div>
<div>
<div>Dr. Maxime Cuypers<br>
</div>
</div>
</div>
</div>
</div>
</div>
</font></span></div>
</div>
</blockquote>
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