<div class="gmail_extra">Hi Ignacio,</div><div class="gmail_extra">actually .cpt contains velocities and, to extract a .gro containing them, you can try to use editconf.</div><div class="gmail_extra"><br></div><div class="gmail_extra">
<br></div><div class="gmail_extra">Francesco<br><br><div class="gmail_quote">Il giorno 23 aprile 2012 16:45, Ignacio Fernández Galván <span dir="ltr"><<a href="mailto:jellby@yahoo.com" target="_blank">jellby@yahoo.com</a>></span> ha scritto:<br>
<blockquote class="gmail_quote" style="margin:0 0 0 .8ex;border-left:1px #ccc solid;padding-left:1ex"><div class="im">--- On Mon, 23/4/12, Alex Marshall <<a href="mailto:amarsh59@uwo.ca">amarsh59@uwo.ca</a>> wrote:<br>
<br>
> I'm pretty sure .cpt files don't store velocity information. Try using a<br>
> trr file instead.<br>
<br>
</div>Well, I'm pretty sure .cpt files do store velocities:<br>
<br>
1. What good would be checkpoint files without velocities?<br>
2. It works with version 4.5.3<br>
3. "gmxcheck -f file.cpt" says, for both 4.5.3 and 4.5.5:<br>
<br>
Step 1<br>
Time 1<br>
Lambda 1<br>
Coords 1<br>
Velocities 1<br>
Forces 0<br>
Box 1<br>
<div class="HOEnZb"><div class="h5">--<br>
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</div></div></blockquote></div><br><br clear="all"><div><br></div>-- <br>Cordiali saluti, Dr.Oteri Francesco<br>
</div>