On 1/19/18 7:09 AM, RAHUL SURESH wrote:
On Fri, Jan 19, 2018 at 4:59 PM, banijamali_fs
wrote:
Hi there,
1. I'm working on MOF (metal organic framewoks) structures. I'd like to
know that if in our topology file we get a decimal figure for the qtot,
in which step we
On Fri, Jan 19, 2018 at 4:59 PM, banijamali_fs
wrote:
> > Hi there,
> >
> > 1. I'm working on MOF (metal organic framewoks) structures. I'd like to
> > know that if in our topology file we get a decimal figure for the qtot,
> > in which step we made a mistake? and how we
> Hi there,
>
> 1. I'm working on MOF (metal organic framewoks) structures. I'd like to
> know that if in our topology file we get a decimal figure for the qtot,
> in which step we made a mistake? and how we can rectify this?
>
> 2. Another question that I have is that when I want to run this
On Fri, Jan 19, 2018 at 2:12 PM, banijamali_fs
wrote:
> Hi there,
>
> 1. I'm working on MOF (metal organic framewoks) structures. I'd like to
> know that if in our topology file we get a decimal figure for the qtot,
> in which step we made a mistake? and how we can
Hi there,
1. I'm working on MOF (metal organic framewoks) structures. I'd like to
know that if in our topology file we get a decimal figure for the qtot,
in which step we made a mistake? and how we can rectify this?
2. Another question that I have is that when I want to run this
command, gmx