[gmx-users] NPT simulation stage

Mahboobeh Eslami mahboobeh.eslami at yahoo.com
Fri Apr 25 08:50:08 CEST 2014


hi GMX users
please help me
i want to simulate protein-ligand complex by gromacs4.6.5
when i repeat NPT simulation stage  many times,  simulation results are very different for the pressure average.I sincerely thank you for your guidance


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