https://cyana.org/w/index.php?action=history&feed=atom&title=CYANA_Functions%3A_dermsCYANA Functions: derms - Revision history2026-05-13T19:50:35ZRevision history for this page on the wikiMediaWiki 1.45.1https://cyana.org/w/index.php?title=CYANA_Functions:_derms&diff=4800&oldid=prevAdmin: 1 revision2009-01-28T23:35:45Z<p>1 revision</p>
<p><b>New page</b></p><div><br />
Synopsis: derms = ''real''<br />
<br />
Real function that returns the RMS total energy change per timestep,<br />
averaged over all timesteps of the most recently executed '''md'''<br />
command. The total energy is given by the sum of the potential energy<br />
(target function) and the kinetic energy. The change of the total<br />
energy from one timestep to the next is calculated before velocity<br />
scaling is applied for controling the temperature.</div>Admin