[gmx-users] Folding simulation using gromacs
AINUN NIZAR M
0810710019 at mail.ub.ac.id
Wed Oct 1 04:08:56 CEST 2014
Dear all users,
I'm a newbie in MD. I would like to simulate a protein folding, from a
primary protein structure to a fully-folded state for a wild type and
mutated protein. Then I will compare them and make movie from unfolded to
folded state. I want to use REMD method. I want to know the system free
energy as well. Can i do it with gromacs?
any kind of information and suggestion are welcome.
sorry for my bad english
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