[gmx-users] MD Simulation run

Quyen V. Vu vuqv.phys at gmail.com
Sun Jun 11 07:06:38 CEST 2017


Hi,
timestep=2fn is safe, you can run 10ns simulation by increasing nsteps
10ns=2fs*5e6, so set nsteps=5000000
Best,
Quyen

<https://www.avast.com/sig-email?utm_medium=email&utm_source=link&utm_campaign=sig-email&utm_content=webmail&utm_term=icon>
Virus-free.
www.avast.com
<https://www.avast.com/sig-email?utm_medium=email&utm_source=link&utm_campaign=sig-email&utm_content=webmail&utm_term=link>
<#DAB4FAD8-2DD7-40BB-A1B8-4E2AA1F9FDF2>


More information about the gromacs.org_gmx-users mailing list