[CP2K-user] [CP2K:19871] COLVAR for metaydnamics
bijaya pathak
bijayapathak85 at gmail.com
Fri Feb 2 07:46:09 UTC 2024
Dear all,
I'm trying to carryout a metadynamics simulation using COM-COM distance as
my collective variable for a dimeric system.
I have done metadynamics simulations previously, but the CV was bond
distance.
Can anyone please help me with defining COM-COM distance as CV for
metadynamics ?
Thanking in advance.
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