Action: REWEIGHT_METAD
Module | bias |
---|---|
Description | Usage |
Calculate the weights configurations should contribute to the histogram in a simulation in which a metadynamics bias acts upon the system. | |
output value | type |
the weight to use for this frame to negate the effect the metadynamics bias | scalar |
Input
The arguments that serve as the input for this action are specified using one or more of the keywords in the following table.
Keyword | Type | Description |
---|---|---|
ARG | scalar | the biases that must be taken into account when reweighting |
Further details and examples
Text from manual goes here
Syntax
The following table describes the keywords and options that can be used with this action
Keyword | Type | Default | Description |
---|---|---|---|
ARG | input | none | the biases that must be taken into account when reweighting |
TEMP | optional | not used | the system temperature |