<html>
<head>
<meta content="text/html; charset=ISO-8859-1"
http-equiv="Content-Type">
</head>
<body bgcolor="#FFFFFF" text="#000000">
On 21/10/2011 10:49 PM, Chandan Choudhury wrote:
<blockquote
cite="mid:CAHESojzSiJ2OtiQMG9sesTAad74SO6reei6r=jkU5Ruf=AoyHw@mail.gmail.com"
type="cite">Hi gmx-users,
<div><br clear="all">
Is it possible to extend a simulation with change in the output
control parameter (nstxtcout)? <br>
</div>
</blockquote>
<br>
Yes, but not with tpbconv. Take your original .mdp file, change what
you want, invoke grompp the same way. You can either give the
checkpoint file to grompp -t or to mdrun -cpi depending what you are
doing.<br>
<br>
Mark<br>
<br>
<blockquote
cite="mid:CAHESojzSiJ2OtiQMG9sesTAad74SO6reei6r=jkU5Ruf=AoyHw@mail.gmail.com"
type="cite">
<div>
<div>I am aware of that tpbconv can extend a simulation with the
same output controls as in the input tpr file.</div>
<div><br>
</div>
<div>Chandan<br>
--<br>
Chandan kumar Choudhury<br>
NCL, Pune<br>
INDIA<br>
</div>
</div>
<br>
<fieldset class="mimeAttachmentHeader"></fieldset>
<br>
</blockquote>
<br>
</body>
</html>