rs
> >Subject: Re: [gmx-users] program crashes when -table option used
> >Date: Fri, 14 Jul 2006 02:13:54 -0400
> >
> >Yang Ye,
> >
> >I just can't understand why the program ran fine in one way, but crashed
> >in another way. If the two coordinates file
By the way, it seems David has not told us how to input multiple
tablep.xvg files, right?
you can have one table.xvg and one tablep.xvg
No, you can have multiple normal tables (see energygrp_table),
but only one pair table.
Berk.
___
gmx-users m
From: Dongsheng Zhang <[EMAIL PROTECTED]>
Reply-To: Discussion list for GROMACS users
To: Discussion list for GROMACS users
Subject: Re: [gmx-users] program crashes when -table option used
Date: Fri, 14 Jul 2006 02:13:54 -0400
Yang Ye,
I just can't understand why the program
Dongsheng Zhang wrote:
Yang Ye,
I just can't understand why the program ran fine in one way, but crashed
in another way. If the two coordinates file are the same, how come did
the second run give me large value of LJ_14? If it is possible, I can
give you my two tpr file, you can do the test.
p
Yang Ye,
I just can't understand why the program ran fine in one way, but crashed
in another way. If the two coordinates file are the same, how come did
the second run give me large value of LJ_14? If it is possible, I can
give you my two tpr file, you can do the test.
I used a coarse grained mod
reduce timestep or further minimization/equilibration?
Yang Ye
Dongsheng Zhang wrote:
Dear GMX users,
I have a coarse-grained model whose nonbonded potentials are tabulated,
so I have to use user defined potential in gromacs. With Yang Ye's great
help, I can implement the new force field. How
Dear GMX users,
I have a coarse-grained model whose nonbonded potentials are tabulated,
so I have to use user defined potential in gromacs. With Yang Ye's great
help, I can implement the new force field. However, the program always
crashed because of Large VCM(group rest). I have done a test by r
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