From: Giacomo Fiorin (giacomo.fiorin_at_gmail.com)
Date: Thu Jul 22 2021 - 08:29:28 CDT
Hello Vidhya, from the documentation about how to define a colvar:
https://urldefense.com/v3/__https://colvars.github.io/colvars-refman-namd/colvars-refman-namd.html*sec:colvar__;Iw!!DZ3fjg!rYlTVJ26R1Gsy_zx4gIdginc6ggIUOc396LIQTaUXBZ-h1pM68XB29R_u16zkzMdnw$
You can read specifically about the grid parameters that you're referring
to:
https://urldefense.com/v3/__https://colvars.github.io/colvars-refman-namd/colvars-refman-namd.html*sec:colvar_grid_params__;Iw!!DZ3fjg!rYlTVJ26R1Gsy_zx4gIdginc6ggIUOc396LIQTaUXBZ-h1pM68XB29R_u17tGGFSJw$
In particular, "width 1" is the default, so you can safely leave it out.
Set lowerBoundary and upperBoundary as the widest interval of possible
values of the variable.
Giacomo
On Thu, Jul 22, 2021 at 9:21 AM Vidhya Sankar <
vidhyasankar7928_at_remove_yahoo.com> wrote:
> Dear Namd user I am using Meta dynamic using Path collective variables
> .I would like to know how to set * lowerBoundary upperBoundary
> and width 1.0*
> *It would be highly **appreciable** if someone suggest the method of
> assigning values*
> *With High Regards*
> *S.VIDHYA SANKAR*
>
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