Thanks! And I&#39;ve learned that Pymol can also do the job.<br><br>
<div class="gmail_quote">2008/7/12 DEEPESH AGARWAL &lt;<a href="mailto:deepesh.iitd@gmail.com">deepesh.iitd@gmail.com</a>&gt;:<br>
<blockquote class="gmail_quote" style="PADDING-LEFT: 1ex; MARGIN: 0px 0px 0px 0.8ex; BORDER-LEFT: #ccc 1px solid">Hi,<br><br>In addition to what Justin has suggested, VMD has a tool to mutate a<br>residue- Extensions&gt;Modeling&gt;Mutate residue.<br>
<font color="#888888"><br>Deepesh<br></font>
<div>
<div></div>
<div class="Wj3C7c"><br><br>On 7/12/08, Justin A. Lemkul &lt;<a href="mailto:jalemkul@vt.edu">jalemkul@vt.edu</a>&gt; wrote:<br>&gt;<br>&gt;<br>&gt; Lee Soin wrote:<br>&gt;&gt; Hi!<br>&gt;&gt; Is there a command in GROMACS that can substitute the atoms of a whole<br>
&gt;&gt; residue for another? This is quite useful in doing mutation simulations.<br>&gt;&gt; Or if that&#39;s not possible, how should I mutate a residue? Thanks!<br>&gt;<br>&gt; I would use a program like DeepView (Swiss-PDBViewer), or maybe Modeller.<br>
&gt;<br>&gt; -Justin<br>&gt;<br>&gt;&gt;<br>&gt;&gt; --<br>&gt;&gt; Sun Li<br>&gt;&gt; Department of Physics<br>&gt;&gt; Nanjing University, China<br>&gt;&gt;<br>&gt;&gt;<br>&gt;&gt; ------------------------------------------------------------------------<br>
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&gt;<br>&gt; --<br>&gt; ========================================<br>&gt;<br>&gt; Justin A. Lemkul<br>&gt; Graduate Research Assistant<br>&gt; Department of Biochemistry<br>&gt; Virginia Tech<br>&gt; Blacksburg, VA<br>&gt; jalemkul[at]<a href="http://vt.edu/" target="_blank">vt.edu</a> | (540) 231-9080<br>
&gt; <a href="http://www.bevanlab.biochem.vt.edu/Pages/Personal/justin" target="_blank">http://www.bevanlab.biochem.vt.edu/Pages/Personal/justin</a><br>&gt;<br>&gt; ========================================<br>&gt; _______________________________________________<br>
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&gt; Please search the archive at <a href="http://www.gromacs.org/search" target="_blank">http://www.gromacs.org/search</a> before posting!<br>&gt; Please don&#39;t post (un)subscribe requests to the list. Use the<br>&gt; www interface or send it to <a href="mailto:gmx-users-request@gromacs.org">gmx-users-request@gromacs.org</a>.<br>
&gt; Can&#39;t post? Read <a href="http://www.gromacs.org/mailing_lists/users.php" target="_blank">http://www.gromacs.org/mailing_lists/users.php</a><br>&gt;<br>_______________________________________________<br>gmx-users mailing list &nbsp; &nbsp;<a href="mailto:gmx-users@gromacs.org">gmx-users@gromacs.org</a><br>
<a href="http://www.gromacs.org/mailman/listinfo/gmx-users" target="_blank">http://www.gromacs.org/mailman/listinfo/gmx-users</a><br>Please search the archive at <a href="http://www.gromacs.org/search" target="_blank">http://www.gromacs.org/search</a> before posting!<br>
Please don&#39;t post (un)subscribe requests to the list. Use the<br>www interface or send it to <a href="mailto:gmx-users-request@gromacs.org">gmx-users-request@gromacs.org</a>.<br>Can&#39;t post? Read <a href="http://www.gromacs.org/mailing_lists/users.php" target="_blank">http://www.gromacs.org/mailing_lists/users.php</a><br>
</div></div></blockquote></div><br><br clear="all"><br>-- <br>Sun Li<br>Department of Physics<br>Nanjing University, China