[
> gromacs.org_gmx-users-boun...@maillist.sys.kth.se] Em Nome De Sathish
> Kumar [sathishk...@gmail.com]
> Enviado: segunda-feira, 9 de Dezembro de 2013 4:21
> Para: Discussion list for GROMACS users
> Assunto: [gmx-users] Fwd: Normal Mode Analysis
>
> Dear users,
>
>
...@maillist.sys.kth.se] Em Nome De Sathish Kumar
[sathishk...@gmail.com]
Enviado: segunda-feira, 9 de Dezembro de 2013 4:21
Para: Discussion list for GROMACS users
Assunto: [gmx-users] Fwd: Normal Mode Analysis
Dear users,
I am trying to do NMA
First i did energy minimization using
Dear users,
I am trying to do NMA
First i did energy minimization using .mdp file with conjugate gradient
method,
Next i calculated hessian matrix by using integrator = nm
Then i calculated the eigen vectors from 7 to 100 using g_nmeig
to analyze eigen vectors i use the comm
Dear users,
I am trying to do NMA
First i did energy minimization using .mdp file with conjugate gradient
method,
Next i calculated hessian matrix by using integrator = nm
I was calculated the eigen vectors, eigen values and eigen frequences by
using the following command
g
