<br clear="all"><div><span style="font-family:arial,sans-serif;font-size:13px;background-color:rgb(255,255,255)">Dear Gromacs experts,</span><br style="font-family:arial,sans-serif;font-size:13px;background-color:rgb(255,255,255)">
<br style="font-family:arial,sans-serif;font-size:13px;background-color:rgb(255,255,255)"><span style="font-family:arial,sans-serif;font-size:13px;background-color:rgb(255,255,255)">I want to ask about coulomb energies. Like if coulomb-SR and coulomb-14</span><br style="font-family:arial,sans-serif;font-size:13px;background-color:rgb(255,255,255)">
<span style="font-family:arial,sans-serif;font-size:13px;background-color:rgb(255,255,255)">show high RMSD then what should we interpret from such results??</span><br style="font-family:arial,sans-serif;font-size:13px;background-color:rgb(255,255,255)">
<br style="font-family:arial,sans-serif;font-size:13px;background-color:rgb(255,255,255)"><span style="font-family:arial,sans-serif;font-size:13px;background-color:rgb(255,255,255)"> Average Coulomb Energy (kJ/mol)</span><br style="font-family:arial,sans-serif;font-size:13px;background-color:rgb(255,255,255)">
<br style="font-family:arial,sans-serif;font-size:13px;background-color:rgb(255,255,255)"><span style="font-family:arial,sans-serif;font-size:13px;background-color:rgb(255,255,255)">-1.62657e+06</span><br style="font-family:arial,sans-serif;font-size:13px;background-color:rgb(255,255,255)">
<br style="font-family:arial,sans-serif;font-size:13px;background-color:rgb(255,255,255)"><span style="font-family:arial,sans-serif;font-size:13px;background-color:rgb(255,255,255)">RMSD</span><br style="font-family:arial,sans-serif;font-size:13px;background-color:rgb(255,255,255)">
<br style="font-family:arial,sans-serif;font-size:13px;background-color:rgb(255,255,255)"><span style="font-family:arial,sans-serif;font-size:13px;background-color:rgb(255,255,255)">2236.85</span><br style="font-family:arial,sans-serif;font-size:13px;background-color:rgb(255,255,255)">
<br style="font-family:arial,sans-serif;font-size:13px;background-color:rgb(255,255,255)"><span style="font-family:arial,sans-serif;font-size:13px;background-color:rgb(255,255,255)">Error Estimation</span><br style="font-family:arial,sans-serif;font-size:13px;background-color:rgb(255,255,255)">
<br style="font-family:arial,sans-serif;font-size:13px;background-color:rgb(255,255,255)"><span style="font-family:arial,sans-serif;font-size:13px;background-color:rgb(255,255,255)">150</span><br style="font-family:arial,sans-serif;font-size:13px;background-color:rgb(255,255,255)">
<br style="font-family:arial,sans-serif;font-size:13px;background-color:rgb(255,255,255)"><span style="font-family:arial,sans-serif;font-size:13px;background-color:rgb(255,255,255)">Total drift (kJ/mol)</span><br style="font-family:arial,sans-serif;font-size:13px;background-color:rgb(255,255,255)">
<br style="font-family:arial,sans-serif;font-size:13px;background-color:rgb(255,255,255)"><span style="font-family:arial,sans-serif;font-size:13px;background-color:rgb(255,255,255)">-894.82</span><br style="font-family:arial,sans-serif;font-size:13px;background-color:rgb(255,255,255)">
<br style="font-family:arial,sans-serif;font-size:13px;background-color:rgb(255,255,255)"><br style="font-family:arial,sans-serif;font-size:13px;background-color:rgb(255,255,255)"><span style="font-family:arial,sans-serif;font-size:13px;background-color:rgb(255,255,255)">Many thanks</span>
</div>-- <br>Saba Ferdous<div>Research Scholar (M. Phil)</div><div>National Center for Bioinformatics</div><div>Quaid-e-Azam University, Islamabad</div><div>Pakistan</div><br>