Difference between revisions of "Molecular Dynamics Simulations HEXA"

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(Detailed results)
(Run the MD simulation)
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=== Run the MD simulation ===
 
=== Run the MD simulation ===
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Here we want to give a receipt for how to analyse the MD simulation result as we did it in our section.
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* check the trajectory
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  +
gmxcheck -f traj.xtc
   
 
=== Detailed results ===
 
=== Detailed results ===

Revision as of 10:21, 20 September 2011

Run the MD simulation

Here we want to give a receipt for how to analyse the MD simulation result as we did it in our section.

  • check the trajectory
gmxcheck -f traj.xtc

Detailed results

Comparison of the results

Discussion