Re: The best initial structure of Protein-Protein complex

From: ROPÓN-PALACIOS G. (biodano.geo_at_gmail.com)
Date: Mon Feb 24 2020 - 09:54:28 CST

Hi Alireza,

you can use HADDOCK, actually is el best program for make docking
protein-protein. Also is suggest that you use any type of restriction for
your docking, for get best pose.

El lun., 24 de feb. de 2020 a la(s) 05:21, Alireza Mansouri (
alireza_mansouri89_at_remove_yahoo.com) escribió:

> Dear NAMD users,
>
> I would like to research on the interaction between two proteins using MD
> Simulation. However, I do not know what the best way is to obtain the
> initial structure of protein/protein complex before simulation. As far as I
> know, there are some docking web servers and software like Hex8, which can
> be used for this work. I did some docking simulations and found that each
> software or server provided different result (different proteins
> orientation).
>
> Can anyone please offer me some advice?
>
> Can I use the result of Hex 8 for my MD Simulation?
> Thanks in advance
> Alireza
>
>
>
>
>
>

--

This archive was generated by hypermail 2.1.6 : Thu Dec 31 2020 - 23:17:12 CST