Action: EFFECTIVE_ENERGY_DRIFT

Module	generic
Description	Usage
Print the effective energy drift

Further details and examples

Text from manual goes here

References

More information about how this action can be used is available in the following articles:

M. J. Ferrarotti, S. Bottaro, A. Pérez-Villa, G. Bussi, Accurate Multiple Time Step in Biased Molecular Simulations. Journal of Chemical Theory and Computation. 11, 139–146 (2014)

Syntax

The following table describes the keywords and options that can be used with this action

Keyword	Type	Default	Description
STRIDE	compulsory	1	should be set to 1
FILE	compulsory	none	file on which to output the effective energy drift
PRINT_STRIDE	compulsory	none	frequency to which output the effective energy drift on FILE
ENSEMBLE	optional	false	Set to TRUE if you want to average over multiple replicas
FMT	optional	not used	the format that should be used to output real numbers
RESTART	optional	not used	allows per-action setting of restart (YES/NO/AUTO)
UPDATE_FROM	optional	not used	Only update this action from this time
UPDATE_UNTIL	optional	not used	Only update this action until this time