<div>Dear GMX developers,</div>
<div>I&#39;ve got a question on the analys tool of gromacs - g_energy</div>
<div>during MD I define 2 energy groups for energy calculation.</div>
<div>thus after run, I&#39;ve got values for different interations</div>
<div>such us </div>
<div>LJ-14<br>Coulomb-14<br>LJ-(SR)<br>LJ-(LR)<br>Coulomb-(SR)<br>Coulomb-(LR)<br>Pressure-(bar)<br>Potential<br>Kinetic-En.<br>Total-Energy<br>Coul-SR:Poly-Poly<br>LJ-SR:Poly-Poly<br>Coul-LR:Poly-Poly<br>LJ-LR:Poly-Poly
<br>Coul-14:Poly-Poly<br>LJ-14:Poly-Poly<br>Coul-SR:Poly-SOL<br>LJ-SR:Poly-SOL<br>Coul-LR:Poly-SOL<br>LJ-LR:Poly-SOL<br>Coul-14:Poly-SOL<br>LJ-14:Poly-SOL<br>Coul-SR:SOL-SOL<br>LJ-SR:SOL-SOL<br>Coul-LR:SOL-SOL<br>LJ-LR:SOL-SOL
<br>Coul-14:SOL-SOL<br>LJ-14:SOL-SOL<br>&nbsp;<br clear="all">and the question is:<br>what kind if interactions consists, for example term</div>
<div>LJ-(SR)</div>
<div>he is equal for =LJ-SR:Poly-Poly+LJ-SR:Poly-SOL+LJ-SR:SOL-SOL</div>
<div>or not?</div>
<div>and what about other?</div>
<div>-- <br>Dmitriy Golubovsky </div>