NAMD+PLUMED

From: jing liang (jingliang2015_at_gmail.com)
Date: Sat Jun 02 2018 - 13:34:26 CDT

Hi,

I tried to run a Metadynamics simulation in NAMD using Colvars on a GPU
card but it seems that this type of simulations is not supported yet on
GPUs,
right?

Then, I read about an alternative for Colvars called PLUMED. Do you know
if NAMD+PLUMED can be run on GPUs?

Compared to Colvars, does PLUMED runs faster or scales better with the
number of cores for instance?

Any comment is welcome.

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