[gmx-users] help- ionic liquid

Mark Abraham Mark.Abraham at anu.edu.au
Mon Nov 3 05:08:41 CET 2008

naimah haron naimah wrote:
> how to do molecular dynamics for ionic liquids by using GROMACS. Can u 
> tell me the correct method to do molecular dynamics and which topologies 
> are suitable for use with NMR-type calculations or all-atom force fields.

This question is too general for volunteers to help you with. Start with 
a Google search, some reading of the GROMACS manual, or doing some 
GROMACS tutorials. Then, if you need to, come back with focussed questions.


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