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ABolfazl Noorjahan

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09/21/2013

02:09 AM GROMACS Bug #1339: Center of mass drift with Nose-Hoover, MTTK and md-vv
Here I am attaching the Velocity of center of mass during time. I tried to zoom in to see the time scale on which the...

09/20/2013

09:38 PM GROMACS Bug #1339: Center of mass drift with Nose-Hoover, MTTK and md-vv
Yes, the center of mass of the whole system (which is a polymer chain with 400 monomer) is drifting. The box shape st...

09/19/2013

10:22 PM GROMACS Bug #1339: Center of mass drift with Nose-Hoover, MTTK and md-vv
I am attaching the topol.top file in case if you need it.
10:20 PM GROMACS Bug #1339 (New): Center of mass drift with Nose-Hoover, MTTK and md-vv
Simulation of single long polymer chain shows huge center of mass drift during microsecond simulation.
The very same...

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