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<p>Dear Hiromu,</p>
<p>you may download the whole SMILES file (allcod.smi) or its parts
from <a class="moz-txt-link-freetext" href="http://www.crystallography.net/cod/smi/">http://www.crystallography.net/cod/smi/</a>. You may also use
Subversion protocol to obtain these files from
svn://www.crystallography.net/cod/smi.</p>
<p>Hope it helps,<br>
Andrius<br>
</p>
On 05/13/2018 04:02 PM, 江頭 啓 Hiromu Egashira wrote:<br>
<blockquote type="cite"
cite="mid:CALCD4iW+zd666J0f3XRm=fNg4My9hFd_uvabNn=UJkVuXrNM1A@mail.gmail.com">
<div dir="ltr"><font face="arial, helvetica, sans-serif">Dear COD
administrator, </font>
<div><font face="arial, helvetica, sans-serif"><br>
</font></div>
<div><font face="arial, helvetica, sans-serif">I'm Hiromu
Egashira, computer chemist, belong to ONO Pharmaceutical in
Japan. COD is quite useful for me to search ligand crystal
data.</font></div>
<div><font face="arial, helvetica, sans-serif">I would like to
search many compounds at once, so I would like to download
the SMILES from COD. I found the page "Obtaining COD", but I
couldn't find how to download SMILES. I think you have
SMILES file, because you write "<span
style="color:rgb(255,0,0);text-align:center">substructure
search by SMILES is currently available in a subset of COD
containing </span><span
style="color:rgb(255,0,0);text-align:center;white-space:nowrap">160697 </span><span
style="color:rgb(255,0,0);text-align:center">structures."</span></font></div>
<div><span style="text-align:center"><font style=""
color="#000000"><font face="arial, helvetica, sans-serif">I
will appreciate if you could answer my question.</font></font></span></div>
<div><span style="text-align:center"><font style=""
color="#000000"><font face="arial, helvetica, sans-serif"><br>
</font></font></span></div>
<div><span style="text-align:center"><font style=""
color="#000000"><font face="arial, helvetica, sans-serif">regards,</font></font></span></div>
<div><span style="text-align:center"><font style=""
color="#000000"><font face="arial, helvetica, sans-serif"><br>
</font></font></span></div>
<div><span style="text-align:center"><font style=""
color="#000000"><font face="arial, helvetica, sans-serif">Hiromu</font></font></span></div>
<div><span style="text-align:center"><font style=""
color="#000000"><font face="arial, helvetica, sans-serif">
<div
style="color:rgb(34,34,34);font-style:normal;font-variant-ligatures:normal;font-variant-caps:normal;font-weight:400;letter-spacing:normal;text-align:start;text-indent:0px;text-transform:none;white-space:normal;word-spacing:0px;background-color:rgb(255,255,255);text-decoration-style:initial;text-decoration-color:initial">
<p class="MsoNormal" style="margin:0px">------------------------------<wbr>------------------------------<wbr>------------------------------<wbr>----------</p>
</div>
<div
style="color:rgb(34,34,34);font-style:normal;font-variant-ligatures:normal;font-variant-caps:normal;font-weight:400;letter-spacing:normal;text-align:start;text-indent:0px;text-transform:none;white-space:normal;word-spacing:0px;background-color:rgb(255,255,255);text-decoration-style:initial;text-decoration-color:initial">
<p class="MsoNormal" style="margin:0px"><span
class="gmail-il">Hiromu</span><span> </span><span
class="gmail-il">Egashira</span></p>
</div>
<div
style="color:rgb(34,34,34);font-style:normal;font-variant-ligatures:normal;font-variant-caps:normal;font-weight:400;letter-spacing:normal;text-align:start;text-indent:0px;text-transform:none;white-space:normal;word-spacing:0px;background-color:rgb(255,255,255);text-decoration-style:initial;text-decoration-color:initial">
<p class="MsoNormal" style="margin:0px"><span
class="gmail-il">Group</span><span> </span><span
class="gmail-il">Head</span>,<span> </span><span
class="gmail-il">Group</span><span> </span>II,
Medicinal Chemistry Laboratories III</p>
</div>
<div
style="color:rgb(34,34,34);font-style:normal;font-variant-ligatures:normal;font-variant-caps:normal;font-weight:400;letter-spacing:normal;text-align:start;text-indent:0px;text-transform:none;white-space:normal;word-spacing:0px;background-color:rgb(255,255,255);text-decoration-style:initial;text-decoration-color:initial">
<p class="MsoNormal" style="margin:0px">ONO
Pharmaceutical Co., Ltd.</p>
</div>
<div
style="color:rgb(34,34,34);font-style:normal;font-variant-ligatures:normal;font-variant-caps:normal;font-weight:400;letter-spacing:normal;text-align:start;text-indent:0px;text-transform:none;white-space:normal;word-spacing:0px;background-color:rgb(255,255,255);text-decoration-style:initial;text-decoration-color:initial">
<p class="MsoNormal" style="margin:0px"><a
href="https://na01.safelinks.protection.outlook.com/?url=https%3A%2F%2Fmaps.google.com%2F%3Fq%3D3-1-1%2BSakurai%2C%2BShimamoto-cho%2C%2BMishima-gun%2C%2BOsaka%26entry%3Dgmail%26source%3Dg&data=02%7C01%7CKaren.Williams%40crl.com%7C08cdf87ea09a441d1afd08d58a5e1631%7C374f8930e1504031bb35483215fe5900%7C0%7C0%7C636567059072351027&sdata=nMmYFhEeBKNiM6R8oXrG4ADH%2BFoiaRRtVlNeC6NZH6k%3D&reserved=0"
target="_blank" style="color:rgb(17,85,204)"
moz-do-not-send="true">3-1-1 Sakurai,
Shimamoto-cho, Mishima-gun, Osaka</a><span> </span>618-8585,
Japan</p>
</div>
<div
style="color:rgb(34,34,34);font-style:normal;font-variant-ligatures:normal;font-variant-caps:normal;font-weight:400;letter-spacing:normal;text-align:start;text-indent:0px;text-transform:none;white-space:normal;word-spacing:0px;background-color:rgb(255,255,255);text-decoration-style:initial;text-decoration-color:initial">
<p class="MsoNormal" style="margin:0px">Phone<span> </span><a
href="tel:+81%2075-961-1151" target="_blank"
style="color:rgb(17,85,204)"
moz-do-not-send="true">+81-75-961-1151</a>, Fax<span> </span><a
href="tel:+81%2075-962-9314" target="_blank"
style="color:rgb(17,85,204)"
moz-do-not-send="true">+81-75-962-9314</a></p>
</div>
<div
style="color:rgb(34,34,34);font-style:normal;font-variant-ligatures:normal;font-variant-caps:normal;font-weight:400;letter-spacing:normal;text-align:start;text-indent:0px;text-transform:none;white-space:normal;word-spacing:0px;background-color:rgb(255,255,255);text-decoration-style:initial;text-decoration-color:initial">
<p class="MsoNormal" style="margin:0px">------------------------------<wbr>------------------------------<wbr>------------------------------<wbr>----------</p>
</div>
<br>
</font></font></span></div>
</div>
<br>
<fieldset class="mimeAttachmentHeader"></fieldset>
<br>
<pre wrap="">_______________________________________________
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<a class="moz-txt-link-freetext" href="http://lists.crystallography.net/cgi-bin/mailman/listinfo/cod-bugs">http://lists.crystallography.net/cgi-bin/mailman/listinfo/cod-bugs</a>
</pre>
</blockquote>
<br>
<pre class="moz-signature" cols="0">--
Andrius Merkys
Vilnius University Institute of Biotechnology, Saulėtekio al. 7, room V325
LT-10257 Vilnius, Lithuania</pre>
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