[gmx-users] water density
Raghunadha Reddy Burri
burri at heineken.chemie.uni-dortmund.de
Fri Jun 25 16:28:55 CEST 2004
Dear GMX users,
In my peptide (s) and water in simulation time (pbc = xyz, Pcoupl = berendsen,
tau_p = 1.0, compressibility = 4.6e-5, ref_p = 1.0, in cubic box ), I found
increasing box size as well as decrease water density in box.
But I just wondering there is any way to maintain same water density and
presure though out my simulation!!
Looking for positive reply,
Thank you for your cooperation
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