[gmx-users] Protein transition from active to passive state

Rafał Urniaż sitcome at wp.pl
Wed Feb 22 17:57:28 CET 2012

> Dear Gromacs Users,
> I am interested in opportunities to simulate protein transition from active to passive state.
> Exists a possibility to put into Gromacs two states of protein and forced the transition from
> state A to B? Measuring by the way the energy of the frame state? I will be thanks for 
> any suggestions, tutorials or publications to read. 
> Best regards
> Rafal

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