[gmx-users] Re: implicit solvent and REMD

Xavier Periole x.periole at chem.rug.nl
Mon Apr 26 17:32:05 CEST 2004

You would have to check the time scale in which your protein must
unfold !! Perhaps it is unreacheable within MD time scale.

The other point is that the force fields in general have not been built
for high temperature simulations. The results have to be interpreted with


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