<html><body style="word-wrap: break-word; -webkit-nbsp-mode: space; -webkit-line-break: after-white-space; ">
That's true ;-)<div>but you can always use (and I highly suggest that) the @INCLUDE pre-processing instruction.</div><div>you can check each single file first and then put them together in a more complicated input file </div><div>using the input pre-processor ;-)</div><div><br class="webkit-block-placeholder"></div><div>I'm sure you will have plenty of fun! ;-)</div><div>Teo</div><div><br><div><div>On 27 Aug 2008, at 16:24, Jun Cheng wrote:</div><br class="Apple-interchange-newline"><blockquote type="cite"><div dir="ltr">Dear Teo,<br><br>Thank you for the rapid reply.<br>You were right about my attempt. I will try to add the other two classical force_eva sections to impose the restraints. It will be a long input. :-)<br><br> Regards,<br>Jun<br><br><div class="gmail_quote">On Wed, Aug 27, 2008 at 3:18 PM, Laino Teodoro <span dir="ltr"><<a href="mailto:teodor...@gmail.com">teodor...@gmail.com</a>></span> wrote:<br><blockquote class="gmail_quote" style="border-left: 1px solid rgb(204, 204, 204); margin: 0pt 0pt 0pt 0.8ex; padding-left: 1ex;"> <div style=""> Dear Jun,<div>it is not possible since by definition restraints are applied at the MD level.. and your MD will be performed globally (i.e. on one system combination</div><div>of the two states).</div><div>What you want is to add maybe a classical term (like a bond) to your force_eval.. this makes everything more </div> <div>complicated but in principle feasible.</div><div>good luck!</div><div>Teo</div><div><br></div><div><br><div><div>On 27 Aug 2008, at 15:55, Jun wrote:</div><br><blockquote type="cite"><div style="margin-top: 0px; margin-right: 0px; margin-bottom: 0px; margin-left: 0px; "><font style="font-family: Helvetica; font-style: normal; font-variant: normal; font-weight: normal; font-size: 12px; line-height: normal; font-size-adjust: none; font-stretch: normal;" face="Helvetica" size="3">exactly the same restraints. Does anybody know how to specify the</font></div><div style="margin-top: 0px; margin-right: 0px; margin-bottom: 0px; margin-left: 0px; "><font style="font-family: Helvetica; font-style: normal; font-variant: normal; font-weight: normal; font-size: 12px; line-height: normal; font-size-adjust: none; font-stretch: normal;" face="Helvetica" size="3">restraints separately?</font></div> </blockquote></div><br></div><br> </div><br> </blockquote></div><br></div><br> <br> <br></blockquote></div><br></div></body></html>