[gmx-users] Tabulated potential error
mark.j.abraham at gmail.com
Fri Nov 13 11:29:51 CET 2015
Why do think you have a particle 2.6nm from another interacting with it?
On Fri, Nov 13, 2015 at 11:06 AM Pallavi Banerjee <
pallavisept at students.iiserpune.ac.in> wrote:
> Hello all,
> I am carrying out Iterative Boltzmann inversion on a polymer-water system.
> I provide tabulated bond, angle, dihedral and a selected few non-bonded
> interactions as input in the tabulated format. After only a few md steps, I
> get the following error:
> A tabulated bond interaction table number 1 is out of the table range: r
> 2.648816, between table indices 1324 and 1325, table length 1251
> What could be done to circumvent this issue?
> Many Thanks
> -Pallavi Banerjee
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