[gmx-users] Grandcanonical Ensemble

mohsen ramezanpour ramezanpour.mohsen at gmail.com
Tue Mar 15 14:32:19 CET 2011


Dear All

1-Does Gromacs support Grandcanonical ensemble too?

2-I want to increase the length of my simulation box during simulation,Is it
possible?

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?

Thanks in advance
Mohsen
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