Dear Lammps Users:
Now I’am running an all-atom simulation of 2.6nm2.6nm2.6nm box containing 8 chains composed of 4 monomer per chain. The total number of the atom system is about 1300. My question is: how long the simulation time is for the model above, or for the normal case, until the molecular system be considered as final relaxation.The answer of the question is very important for me. Would you give some introduction. And any relative information is welcome.
best wishes ~
D. Chai
Dear Lammps Users:
Now I'am running an all-atom simulation of 2.6nm*2.6nm*2.6nm box
containing 8 chains composed of 4 monomer per chain. The total number of the
atom system is about 1300. My question is: how long the simulation time is
for the model above, or for the normal case, until the molecular system be
considered as final relaxation.The answer of the question is very important
impossible to say. depends very much on your system.
for me. Would you give some introduction. And any relative information is
sorry, but this is a discussion you should have with your adviser or
whoever is advising you on basic MD methodology. there are whole book
chapters written on these topics.
axel.
Yes, I must read the part of introducing the relaxation seriously. Thank you all the same, Axel.