[gmx-users] maximum energy in ipnic liquid

Andy Chao achao at energiaq.com
Mon Jul 28 18:06:03 CEST 2014

Dear gromacs users:

is there any gromacs command that can allow us to compute the maximum
allowable energy that can be sustained on an ionic liquid structure?

in other words, instead of energy minimization, we would like to
compute maximum energy under stability.



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