[gmx-users] protein structure prediction

Mark Abraham Mark.Abraham at anu.edu.au
Mon Feb 23 12:55:33 CET 2009

José Carlos Calvo Tudela wrote:
> can I use the GROMACS software to get the energy of a protein conformation?

Yes, but your question is not well-formed. Only energy differences can 
have meaning.

> Up to now I am using TINKER library (analyze program). Is there any 
> similar software in GROMACS?

I don't know.


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