<div dir="ltr">While I can probably fight my way around installing easyblocks, it would be useful for the general user if a bit more information was provided (by you or your local HPC team). For instance, I suspect it is something like:<div>
<br></div><div>* Download the easyblocks module from <a href="http://hpcugent.github.com/easybuild" style="color:rgb(65,131,196);outline:0px;font-family:Helvetica,arial,freesans,clean,sans-serif,'Segoe UI Emoji','Segoe UI Symbol';font-size:15px;line-height:25.5px;background-image:initial;background-repeat:initial">http://hpcugent.github.com/easybuild</a> (what else is needed ?)</div>
<div>* cd to the directory (unzip ?) and do "python setup.py install'' (is root access needed ?)</div><div>* Download the script xcrysden (to xcrysden directory ?)</div><div>* do "python xcrysden.py"</div>
<div><br></div><div>N.B., I am probably missing some steps such as setting CC and other environmental variables.including destination.</div></div><div class="gmail_extra"><br><br><div class="gmail_quote">On Wed, Jul 16, 2014 at 12:48 PM, Michael Sluydts <span dir="ltr"><<a href="mailto:michael.sluydts@ugent.be" target="_blank">michael.sluydts@ugent.be</a>></span> wrote:<br>
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<div>Our local HPC team has been developing a framework called easybuild to quickly recompile various software. They save the configuration in python files called easyblocks. There is one for xcrysden. I'm however not sure if there were
any remaining issues (and testing it again/making a new compile has been on my to do list).<br>
<br>
The easyblock can be found here:<br>
<br>
<a href="https://github.com/hpcugent/easybuild-easyblocks/blob/master/easybuild/easyblocks/x/xcrysden.py" target="_blank">https://github.com/hpcugent/easybuild-easyblocks/blob/master/easybuild/easyblocks/x/xcrysden.py</a><br>
<br>
Laurence Marks schreef op 16/07/2014 19:41:<br>
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<div dir="ltr">Has anyone worked through a .configure (or similar) script for Xcrygen. The shared & semishared versions on the web page are not that compatible with recent systems, and I hate (am too lazy) to start editing makefiles by hand.<br>
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-- <br>
Professor Laurence Marks<br>
Department of Materials Science and Engineering<br>
Northwestern University<br>
<a href="http://www.numis.northwestern.edu" target="_blank">www.numis.northwestern.edu</a> 1-847-491-3996<br>
Co-Editor, Acta Cryst A<br>
"Research is to see what everybody else has seen, and to think what nobody else has thought"<br>
Albert Szent-Gyorgi </div>
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</blockquote></div><br><br clear="all"><div><br></div>-- <br>Professor Laurence Marks<br>Department of Materials Science and Engineering<br>Northwestern University<br><a href="http://www.numis.northwestern.edu" target="_blank">www.numis.northwestern.edu</a> 1-847-491-3996<br>
Co-Editor, Acta Cryst A<br>"Research is to see what everybody else has seen, and to think what nobody else has thought"<br>Albert Szent-Gyorgi
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