I am interested in performing shear flow simulations of molecular fluids by application of the SLLOD equations of motions combined with Lees-Edwards boundary conditions and thermostats. So far I have studied rather simple molecules and small systems, so that I have been able to use computer programs that I have written myself. However, I would like to simulate more realistic systems and technically important molecules, so I have to use a more sophisticated code. Therefore, I wonder if you know whether the SLLOD equations of motion can be handled by PROTOMOL Since I want to study ionic systems I wonder whether the Ewald summation for Lees Edwards boundary conditions is implemented?
Are you asking a question about LAMMPS?