[gmx-users] Re: Re: .top

Bhawana Gupta bhawana.gupta2010 at gmail.com
Fri Nov 14 05:47:41 CET 2008


hello everyone,

thankyou for your reply.
if interchanging water topolgy and position restraint position,mean that it
is being applied to water, not the molecule. Then what should i do so that i
dont get error when i put it in order of
#include "ffgmx.itp"
  #include "boc.itp"
#include "spc.itp"
#include "posre.itp"
and also my molecule can restrain.
Sorry ,but pls help me out
i will change my forcefield in next one.

Bhawana
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