Re: [modeller_usage] conjugate gradients or molecular dynamics optimizations with automodel.make()
To: Li SUN <>,
Subject: Re: [modeller_usage] conjugate gradients or molecular dynamics optimizations with automodel.make()
From: Modeller Caretaker <>
Date: Tue, 15 Jul 2014 09:50:58 -0700
On 7/14/14, 8:39 PM, Li SUN wrote:
I have a question regarding the usage of automodel.make() for modelling
a protein structure from known structures. Does this function include
optimization methods e.g. conjugate gradients or molecular dynamics so
that it will output a structure close to the native state (lowest-energy
state)