<html><head></head><body><div class="ydp642a169yahoo-style-wrap" style="font-family:verdana, helvetica, sans-serif;font-size:13px;"><div dir="ltr" data-setdir="false">Hi there</div><div dir="ltr" data-setdir="false"><br></div><div dir="ltr" data-setdir="false"><div><div dir="ltr" data-setdir="false">I have a general question: I would like to find out the global minimum of a guest molecule within the pore of a MOF. I know I can place the guest molecule in the pore and get the host-guest structure optimized, but if I would place the guest molecule in another position of the same pore, there also I can get the structure optimized. In this scenario how could I find the exact most probable location of the guest molecule within the MOF pore or its global minimum...?</div><div><br></div><div>Any help would be highly appreciated...</div></div></div><br></div><div class="ydp642a169yahoo-style-wrap" style="font-family:verdana, helvetica, sans-serif;font-size:13px;" dir="ltr" data-setdir="false">-Monu</div></body></html>