[gmx-users] Langevin Dynamics

tarak karmakar tarak20489 at gmail.com
Fri Dec 14 13:26:11 CET 2012

Dear All,

I am going to do US simulation in a protein. For this purpose I have
heated the protein from 0 to 300 K by using 'SD' integrator. But I am
bit confused with this integrator.
How good is to use Langevin Dynamics to heat a protein ?


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