AMBER Archive (2009)

Subject: [AMBER] Water-molecules

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Hallo!!!

I m working to simulate water molecules and successfully minimized the
system along with heating. While running simulation I came across the
following

Frac coord min, max: -8.093157865439766E-006 0.774239522699007
 The system has extended beyond
     the extent of the virtual box.
 Restarting sander will recalculate
    a new virtual box with 30 Angstroms
    extra on each side, if there is a
    restart file for this configuration.
 SANDER BOMB in subroutine Routine: map_coords (ew_force.f)
 Atom out of bounds. If a restart has been written,
 restarting should resolve the error

Looking forward for an assistance
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• Previous message: David A. Case: "Re: [AMBER] Papers on Amber package usage"
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