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Thank you <br><br><hr id="stopSpelling">From: x.periole@rug.nl<br>To: gmx-users@gromacs.org<br>Subject: Re: [gmx-users] center of mass<br>Date: Mon, 16 Mar 2009 17:56:16 +0100<br><br><br><div><div>On Mar 16, 2009, at 5:51 PM, Antonia V. wrote:</div><br class="EC_Apple-interchange-newline"><blockquote><span class="EC_Apple-style-span" style="border-collapse: separate; color: rgb(0, 0, 0); font-family: Helvetica; font-size: 12px; font-style: normal; font-variant: normal; font-weight: normal; letter-spacing: normal; line-height: normal; text-indent: 0px; text-transform: none; white-space: normal; word-spacing: 0px;"><div class="EC_hmmessage" style="font-size: 10pt; font-family: Verdana;"><font color="#000000"><tt><pre>Hello,<br><br>I am wondering if there is a tool implemented in GROMACS that computes the<br>coordinates of the center of mass of each molecule of a simulation box.<br><br></pre></tt></font></div></span></blockquote>g_traj -f traj.xtc -com <br><blockquote><span class="EC_Apple-style-span" style="border-collapse: separate; color: rgb(0, 0, 0); font-family: Helvetica; font-size: 12px; font-style: normal; font-variant: normal; font-weight: normal; letter-spacing: normal; line-height: normal; text-indent: 0px; text-transform: none; white-space: normal; word-spacing: 0px;"><div class="EC_hmmessage" style="font-size: 10pt; font-family: Verdana;"><font color="#000000"><tt><pre>Thank you<br>Antonia<br></pre></tt></font><br><hr>Invite your mail contacts to join your friends list with Windows Live Spaces. It's easy!<span class="EC_Apple-converted-space"> </span><a href="http://spaces.live.com/spacesapi.aspx?wx_action=create&wx_url=/friends.aspx&mkt=en-us">Try it!</a><span class="EC_Apple-converted-space"> </span>_______________________________________________<br>gmx-users mailing list <a href="mailto:gmx-users@gromacs.org">gmx-users@gromacs.org</a><br><a href="http://www.gromacs.org/mailman/listinfo/gmx-users">http://www.gromacs.org/mailman/listinfo/gmx-users</a><br>Please search the archive at<span class="EC_Apple-converted-space"> </span><a href="http://www.gromacs.org/search">http://www.gromacs.org/search</a><span class="EC_Apple-converted-space"> </span>before posting!<br>Please don't post (un)subscribe requests to the list. Use the<span class="EC_Apple-converted-space"> </span><br>www interface or send it to<span class="EC_Apple-converted-space"> </span><a href="mailto:gmx-users-request@gromacs.org">gmx-users-request@gromacs.org</a>.<br>Can't post? Read<span class="EC_Apple-converted-space"> </span><a href="http://www.gromacs.org/mailing_lists/users.php">http://www.gromacs.org/mailing_lists/users.php</a></div></span></blockquote></div><br><br /><hr />What can you do with the new Windows Live? <a href='http://www.microsoft.com/windows/windowslive/default.aspx' target='_new'>Find out</a></body>
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