<font><span style="font-family:arial,helvetica,sans-serif">hello sir,</span><br style="font-family:arial,helvetica,sans-serif"><br style="font-family:arial,helvetica,sans-serif"><span style="font-family:arial,helvetica,sans-serif">while performing simulation for 30ns, because of queue time limit my run terminated at 11.6ns.. then i extended my simulation using mdrun as you suggest..</span><br style="font-family:arial,helvetica,sans-serif">
<br style="font-family:arial,helvetica,sans-serif"><span style="font-family:arial,helvetica,sans-serif">while doing so i got error as</span><br style="font-family:arial,helvetica,sans-serif"><br style="font-family:arial,helvetica,sans-serif">
<span style="font-family:arial,helvetica,sans-serif">Fatal error:</span><br style="font-family:arial,helvetica,sans-serif"><span style="font-family:arial,helvetica,sans-serif">Failed to lock: md20.log. Function not implemented.</span><br style="font-family:arial,helvetica,sans-serif">
<span style="font-family:arial,helvetica,sans-serif">For more information and tips for troubleshooting, please check the GROMACS</span><br style="font-family:arial,helvetica,sans-serif"><span style="font-family:arial,helvetica,sans-serif">website at <a href="http://www.gromacs.org/Documentation/Errors">http://www.gromacs.org/Documentation/Errors</a></span><br style="font-family:arial,helvetica,sans-serif">
<br style="font-family:arial,helvetica,sans-serif"><br style="font-family:arial,helvetica,sans-serif"><span style="font-family:arial,helvetica,sans-serif">when i searched in mailing list i got one solution to this as</span><br style="font-family:arial,helvetica,sans-serif">
</font><font style="font-family:arial,helvetica,sans-serif" size="2"><br></font><pre><font style="font-family:arial,helvetica,sans-serif" size="2">as a workaround you could run with -noappend and later
concatenate the output files. Then you should have no
p<font>roblems with locking</font></font><font><span style="font-family:arial,helvetica,sans-serif">.
</span><br style="font-family:arial,helvetica,sans-serif"></font><font style="font-family:arial,helvetica,sans-serif" size="2"><br></font><font size="4"><font style="font-family:times new roman,serif" size="2">now when i tried using -noappend my simulation is working,.<br>
<br>is it correct?? <br><br>Also because my simulation is terminated because of queue limit i didnt get my gro file..<br><br>did i get my gro file at the end of simulation without any error?<br></font><br><br>please help me with your answer..<br>
<br>thanking you,<br><br><br></font><br><br></pre><br>