In God We Trust Hello Dear GMX users We would like to perform MD simulation of a protein in attendance of biomembrane (POPE). On the basis of Kalp tutorial, can we combine position restraints and NPT equlibration in one phase?. We attached NPT.mdp in this mail. Please guide us. Many thanks in advance for your help and your reply. Yours truly Karim Mahnam Institute of Biochemistry and Biophysics (IBB) Tehran University P.O.box 13145-1384 Tehran Iran http://www.ibb.ut.ac.ir/
npt.mdp
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