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Which is not Phenix.. So that explains the difference.<br>
<br>
Question for Nigel is: why elbow.where_is_that_cif_file pulls cif
from CCP4 distribution?<br>
<br>
Pavel<br>
<br>
<div class="moz-cite-prefix">On 1/10/18 14:57, wtempel wrote:<br>
</div>
<blockquote type="cite"
cite="mid:CAGjFzmDFyihbTROLqC2acbODHi8uUps+rP-ZLEPSrJjBVKEHuw@mail.gmail.com">
<div dir="ltr">$CCP4/lib<br>
<div class="gmail_extra"><br>
<div class="gmail_quote">On Wed, Jan 10, 2018 at 5:53 PM,
Pavel Afonine <span dir="ltr"><<a
href="mailto:pafonine@lbl.gov" target="_blank"
moz-do-not-send="true">pafonine@lbl.gov</a>></span>
wrote:<br>
<blockquote class="gmail_quote" style="margin:0 0 0
.8ex;border-left:1px #ccc solid;padding-left:1ex"><br>
<blockquote class="gmail_quote" style="margin:0 0 0
.8ex;border-left:1px #ccc solid;padding-left:1ex">
ideal O3'-C3' bond in *geo is 1.422, which interestingly
matches C3*-O3* in `modules/chem_data/geostd/t/da<wbr>ta_TD.cif`.<br>
</blockquote>
<br>
This is expected. I would be worried if they didn't match.
So, 1.422 is what actually used.<br>
<br>
<blockquote class="gmail_quote" style="margin:0 0 0
.8ex;border-left:1px #ccc solid;padding-left:1ex">
`elbow.where_is_that_cif_file DT` pointed me to
`${CLIB}/data/monomers/d/DT.ci<wbr>f`, where O3'-C3' is
(now, but may be not at time of *geo generation) 1.431.<br>
</blockquote>
<br>
What is ${CLIB} ? I'm wondering because Phenix
distribution does not have "data/monomers" folders (if I
remember correctly).<span
class="m_-5761680062829920146HOEnZb"><font
color="#888888"><br>
<br>
Pavel<br>
<br>
</font></span></blockquote>
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