On 16/03/11, mohsen ramezanpour <ramezanpour.moh...@gmail.com> wrote: > Dear All > > 1-Does Gromacs support Grandcanonical ensemble too? >
No. The number of particles is fixed at grompp time. > 2-I want to increase the length of my simulation box during simulation,Is it > possible? > Only via pressure-coupling. > 3-As a result.I want to do my simulation in grandcanonical in the following > way: > > As the length of my simulation box is increasing,I want to full the new > volume with water molecules.Is this possible with Gromacs? > No. Mark
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