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Back Off! I just backed up step42.pdb to ./#step42.pdb.3#<br><br>Back Off! I just backed up step43.pdb to ./#step43.pdb.1#<br>Wrote pdb files with previous and current coordinates<br>Step= 43, Dmax= 2.7e-01 nm, Epot= -1.73254e+22 Fmax= inf, atom= 211<br>-------------------------------------------------------<br>Program mdrun, VERSION 3.3.1<br>Source code file: nsgrid.c, line: 226<br><br>Range checking error:<br>Explanation: During neighborsearching, we assign each particle to a grid<br>based on its coordinates. If your system contains collisions or parameter<br>errors that give particles very high velocities you might end up with some<br>coordinates being +-Infinity or NaN (not-a-number). Obviously, we cannot<br>put these on a grid, so this is usually where we detect those errors.<br>Make sure your system is properly energy-minimized and that the potential<br>energy seems reasonable before trying again.<br><br>Variable ci has value -2147483648. It should have been within [ 0 .. 729 ]<br>Please report this to the mailing list (gmx-users@gromacs.org)<br>or ricardogobato@hotmail.com<br><br><br>How make for minimization energy? <br><br>Anyone help me Please!!!!!!!!!!!!!!!!!!!<br><br><br><br /><hr />Receba GRÁTIS as últimas novidades do esporte direto no seu Messenger! <a href='http://signup.alerts.live.com/alerts/login.do?PINID=37485679&returnURL=http://www.nivea.com.br' target='_new'>Assine já!</a></body>
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