Try packmol.
On Wed, Mar 1, 2023, 7:45 AM Dhanush Ramesh Anitha via AMBER <
amber.ambermd.org> wrote:
> Good morning everyone,
>
> I want to add organic molecules (for example, benzene) in a random
> order to the water box (containing the protein) in order to perform CMD.
> Can anyone suggest how to do that (tleap code for it) as I am unable to
> find the essential info on it. Looking forward to hear from you soon.
>
> Best,
> Dhanush R A,
> Master Student - UiB
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Received on Wed Mar 01 2023 - 05:00:03 PST
