[gmx-users] MM/Pbsa

[Mark Abraham]

Hi,

Looks like the tool is broken or you've not followed the instructions, or
they are not correct. I suggest starting again and being more careful this
time. Since this is not a gromacs tool, please discuss further with the
author.

Mark

On Thu, 2 Mar 2017 11:25 Kingsley Theras Primus Dass . <
105726107 at gms.tcu.edu.tw> wrote:

> Hi,
>  I tried to calculate binding free energy for my protein. I tried using MM
> / PBSA, when i ran the program i am getting an error. Could you please say
> why such error is occuring and how should i need to rectify it.
>
>
>
> the error message is below
>
>
> 17:54:41
>  The directory RUN_ is not present. Please check the INPUT.dat file or run
> "gmxpbsa0.pbs".
> Exiting -
>
>
> Thank you.
>
> Kingsley Theras
> --
> Gromacs Users mailing list
>
> * Please search the archive at
> http://www.gromacs.org/Support/Mailing_Lists/GMX-Users_List before
> posting!
>
> * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists
>
> * For (un)subscribe requests visit
> https://maillist.sys.kth.se/mailman/listinfo/gromacs.org_gmx-users or
> send a mail to gmx-users-request at gromacs.org.
>