[CP2K-user] [CP2K:19052] plumed and opes problems

Nacho Sanz Martinez naxo.sanzmartinez at gmail.com
Tue Jul 4 10:26:36 UTC 2023


hello everyone,

I normally use classic metadyn simulations, I didn't install the program... 
but it was installed as docker on our local workstation and it uses plumed 
2.8.0  (i can see this in te PLUMED.out file)

I am trying to run a simulation but using opes, and i get the following 
ERROR:
"PLUMED: I can't understand the line: OPES_METAD_EXPLORE LABEL=opes 
ARG=CV1,CV2 PACE=200 .......
Maybe a missing space or a typo?"

Does anyone know how i can fix this problem?

Greetings,

Nacho

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