[IMP-users] Re: Is the hydration layer not used outside of fitting?

[Ben Webb <>]

On 2/5/23 12:59 PM, sammahdi1994--- via IMP-users wrote:
> I've noticed in the FOXS online server, when fitting, you can fix c1
> and c2. However, when looking at the CLI --help, you can only set the
> ranges.
> --min_c1 arg (=0.99)              min c1 value
>    --max_c1 arg (=1.05)              max c1 value
>    --min_c2 arg (=-2.00)             min c2 value
>    --max_c2 arg (=4.00)              max c2 value
> 
> How can you fix c1 and c2 to certain values within the CLI?

Just set the min and max to the same value. This is also what the FoXS 
web server does when it runs the command line tool:
https://github.com/salilab/foxs/blob/d98589b6afd/backend/foxs/run_foxs.py#L67-L75

	Ben
-- 
                      https://salilab.org/~ben/
"It is a capital mistake to theorize before one has data."
	- Sir Arthur Conan Doyle