Hi, Sandeep,<div><br></div><div>Great help. Thanks very much.</div><div><br></div><div>Best,</div><div>Lei<br><br>On Wednesday, October 31, 2012 12:02:17 AM UTC-5, sandeep wrote:<blockquote class="gmail_quote" style="margin: 0;margin-left: 0.8ex;border-left: 1px #ccc solid;padding-left: 1ex;">Hi,<div>    By default, It will restart following quantities.</div><div>(You may see irrelevant keywords being restarted. They can be ignored safely)</div><div><br></div><div><br><div>RESTARTED QUANTITIES:                                                       *</div>
<div> *                       CELL                                                  *</div><div> *                       COORDINATES                                           *</div><div> *                       RANDOM NUMBER GENERATOR                               *</div>
<div> *                       VELOCITIES                                            *</div><div> *                       MD COUNTERS                                           *</div><div> *                       METADYNAMIC COUNTERS                                  *</div>
<div> *                       MD AVERAGES                                           *</div><div> *                       PARTICLE THERMOSTAT                                   *</div><div> *                       CONSTRAINTS/RESTRAINTS                                *</div>
<div> *                       METADYNAMICS                                          *</div><div> *                       REAL TIME PROPAGATION                                 *</div><div> *                       PINT BEAD POSITIONS                                   *</div>
<div> *                       PINT BEAD VELOCITIES                                  *</div><div> *                       PINT NOSE THERMOSTAT                                  *</div><div> *                       PINT GLE THERMOSTAT                                   *</div>
<div> *                       HELIUM BEAD POSITIONS                                 *</div><div> *                       HELIUM PERMUTATION STATE                              *</div><div> *                       HELIUM FORCES ON SOLUTE                               *</div>
<div> *                       HELIUM RNG STATE                  </div><div><br></div><div><br></div><div>It's enough to set it to single line as you did. </div><div><br></div><div>-Sandeep </div><div> </div><div><br></div>
<div><br></div><div><br></div><div><br></div><div class="gmail_quote">On Wed, Oct 31, 2012 at 10:27 AM, stclair <span dir="ltr"><<a href="javascript:" target="_blank" gdf-obfuscated-mailto="6elNrTDyvEwJ">leil...@gmail.com</a>></span> wrote:<br>
<blockquote class="gmail_quote" style="margin:0 0 0 .8ex;border-left:1px #ccc solid;padding-left:1ex">Hi, I have a question about Ext_Restart section.<div><br></div><div>To restart a MD job, I set like below but didn't set up RESTART_VEL,  RESTART_POS and RESTART_THERMOSTAT. In this case, what's the default values of these parameters? I cannot really understand what is discribed in the manual (a lone key work).</div>
<div><div>&EXT_RESTART</div><div>  RESTART_FILE_NAME  *.restart</div><div> &END EXT_RESTART</div></div><div><br></div><div>Thanks.</div><span><font color="#888888">

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