Re: [gmx-users] changing the time step with tpbconv

2008-03-21 Thread David van der Spoel
: David van der Spoel <[EMAIL PROTECTED]> To: Discussion list for GROMACS users Date: Fri, 21 Mar 2008 17:03:06 +0100 Subject: Re: [gmx-users] changing the time step with tpbconv OZGE ENGIN wrote: Hi all, I am performing an 80-ns simulation. During the optimization of the parameters tha

Re: Re: [gmx-users] changing the time step with tpbconv

2008-03-21 Thread OZGE ENGIN
ubject: Re: [gmx-users] changing the time step with tpbconv OZGE ENGIN wrote: > Hi all, > > I am performing an 80-ns simulation. During the optimization of the > parameters that were used in this run, I had performed some small test > simulations, and used short frequency values to

Re: [gmx-users] changing the time step with tpbconv

2008-03-21 Thread David van der Spoel
OZGE ENGIN wrote: Hi all, I am performing an 80-ns simulation. During the optimization of the parameters that were used in this run, I had performed some small test simulations, and used short frequency values to write the velocities. Unfortunately, I did not change this value into a bigger one

[gmx-users] changing the time step with tpbconv

2008-03-21 Thread OZGE ENGIN
Hi all, I am performing an 80-ns simulation. During the optimization of the parameters that were used in this run, I had performed some small test simulations, and used short frequency values to write the velocities. Unfortunately, I did not change this value into a bigger one before starting t