<div dir="ltr">Hi Ole,<div><br></div><div>Sure, I'll put them on the wiki as well. Thanks for the comments!</div><div><br></div><div>Dries<br><br>Op dinsdag 18 juli 2017 13:14:20 UTC+2 schreef Ole Schütt:<blockquote class="gmail_quote" style="margin: 0;margin-left: 0.8ex;border-left: 1px #ccc solid;padding-left: 1ex;">Hi Dries,
<br>
<br>your tutorials are indeed very nice and they fill an important gap our 
<br>documentation concerning QM/MM. Usually, we collect tutorials centrally 
<br>on our wiki: <a href="https://www.cp2k.org/howto" target="_blank" rel="nofollow" onmousedown="this.href='https://www.google.com/url?q\x3dhttps%3A%2F%2Fwww.cp2k.org%2Fhowto\x26sa\x3dD\x26sntz\x3d1\x26usg\x3dAFQjCNH-zNzoTGRYyycg-8r3gRw2-KHZKg';return true;" onclick="this.href='https://www.google.com/url?q\x3dhttps%3A%2F%2Fwww.cp2k.org%2Fhowto\x26sa\x3dD\x26sntz\x3d1\x26usg\x3dAFQjCNH-zNzoTGRYyycg-8r3gRw2-KHZKg';return true;">https://www.cp2k.org/howto</a> . Could I interest you in moving 
<br>them there? The conversion from Markdown to DokuWiki should be straight 
<br>forward.
<br>
<br>In any case, thanks a lot for the work you already put in!
<br>
<br>Cheers,
<br>Ole
<br>
<br>On 2017-07-18 08:49, Dries Van Rompaey wrote:
<br>> Hi cp2k-users,
<br>> 
<br>> After experimenting with cp2k for a while I have written down a short
<br>> tutorial on how to use cp2k for biochemical systems. The tutorial
<br>> covers the setup of an enzyme system with ambertools followed by
<br>> equilibration with cp2k at the MM level, after which we move the
<br>> system to QM/MM for metadynamics simulations of an enzymatic reaction.
<br>> I am far from an expert myself, but I thought this might be useful to
<br>> people starting out. If you spot any mistakes or something that could
<br>> be improved, please let me know. The tutorial can be found at
<br>> <a href="https://driesvr.github.io/Tutorials/" target="_blank" rel="nofollow" onmousedown="this.href='https://www.google.com/url?q\x3dhttps%3A%2F%2Fdriesvr.github.io%2FTutorials%2F\x26sa\x3dD\x26sntz\x3d1\x26usg\x3dAFQjCNHUfeTgDtfHSQQxB98lNzkiPh7cNw';return true;" onclick="this.href='https://www.google.com/url?q\x3dhttps%3A%2F%2Fdriesvr.github.io%2FTutorials%2F\x26sa\x3dD\x26sntz\x3d1\x26usg\x3dAFQjCNHUfeTgDtfHSQQxB98lNzkiPh7cNw';return true;">https://driesvr.github.io/<wbr>Tutorials/</a>.
<br>> 
<br>> Kind regards
<br>> 
<br>> Dries
<br>> 
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